SCHEMBL1231019

SCHEMBL1231019

Brc1cc(-c2ccccc2)ccc1I

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
ALDH1A1 P00352 4/20 0.48
MAPK1 P28482 2/20 0.48
ALOX5 P09917 1/20 0.41
AKR1C4 P17516 1/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
AKR1C1 Q04828 1/20 0.40
MAOA P21397 1/20 0.38
ESR2 Q92731 3/20 0.38
MEN1 O00255 3/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 3/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 2/20 0.38
HTT P42858 2/20 0.38
ESR1 P03372 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29823876 1.00 CRHBP (0.50) CRHBPCRHR2ALDH1A1MAPK1ALOX5
SCHEMBL31197565 1.00 CRHBP (0.50) CRHBPCRHR2ALDH1A1MAPK1ALOX5
SCHEMBL25501487 0.96 CRHBP (0.47) CRHBPCRHR2ALDH1A1MAPK1ALOX5
SCHEMBL16107210 0.82 L3MBTL1 (0.48) CRHBPCRHR2ALDH1A1MAPK1MEN1
SCHEMBL14883138 0.82 ALDH1A1 (0.48) CRHBPCRHR2ALDH1A1MAPK1ALOX5
SCHEMBL29690184 0.81 ESR1 (0.48) ALDH1A1ALOX5ESR2MEN1MAPT
SCHEMBL27105052 0.81 ESR1 (0.48) ALDH1A1ALOX5ESR2MEN1MAPT
SCHEMBL22548367 0.81 ALDH1A1 (0.39) CRHBPCRHR2ALDH1A1MAPK1ALOX5
SCHEMBL16107140 0.79 MEN1 (0.51) ALDH1A1MAPK1MAOAMEN1MAPT
SCHEMBL27105065 0.78 CRHBP (0.47) CRHBPCRHR2ALDH1A1MAPK1ALOX5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 94 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213444-A Tetraphenylsilane derivative and preparation method thereof 陕西维世诺新材料有限公司 2022-03-22 CN claimed
US-12552772-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2026-02-17 US disclosed
US-20250176429-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2025-05-29 US disclosed
US-20250115574-A1 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD VIB VZW (BE) 2025-04-10 US disclosed
EP-4452253-A2 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD The Katholieke Universiteit Leuven (BE) 2024-10-30 EP disclosed
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2024-07-09 US disclosed
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2024-07-09 US disclosed
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD SPRINGWORKS THERAPEUTICS, INC. (US) 2024-07-09 US disclosed
CN-111072661-B Organic electroluminescent device and amine compound for organic electroluminescent device 三星显示有限公司 2024-04-12 CN disclosed
US-11937499-B2 Aromatic amine derivative and organic electroluminescent devices containing the same Beijing Summer Sprout Technology Co., Ltd. (CN) 2024-03-19 US disclosed
US-20110024731-A1 NOVEL CONDENSED POLYCYCLIC AROMATIC COMPOUND AND USE THEREOF NATIONAL UNIVERSITY OF CORP. HIROSHIMA UNIVERSITY (JP) 2011-02-03 US disclosed
US-7834198-B2 Condensed polycyclic aromatic compound and use thereof NATIONAL UNIVERSITY OF CORPORATION HIROSHIMA UNIVERSITY (JP) 2010-11-16 US disclosed
US-7834198-B2 Condensed polycyclic aromatic compound and use thereof NATIONAL UNIVERSITY OF CORPORATION HIROSHIMA UNIVERSITY (JP) 2010-11-16 US disclosed
US-7834198-B2 Condensed polycyclic aromatic compound and use thereof NATIONAL UNIVERSITY OF CORPORATION HIROSHIMA UNIVERSITY (JP) 2010-11-16 US disclosed
CN-101103037-B Novel condensed polycyclic aromatic compound and use thereof NAT UNIVERSITY OF CORP HIROSHI 2010-10-13 CN disclosed
US-20090001357-A1 Novel Condensed Polycyclic Aromatic Compound and Use Thereof NATIONAL UNIVERSITY OF CORP. HIROSHIMA UNIVERSITY (JP) 2009-01-01 US disclosed
US-20090001357-A1 Novel Condensed Polycyclic Aromatic Compound and Use Thereof NATIONAL UNIVERSITY OF CORP. HIROSHIMA UNIVERSITY (JP) 2009-01-01 US disclosed
US-20090001357-A1 Novel Condensed Polycyclic Aromatic Compound and Use Thereof NATIONAL UNIVERSITY OF CORP. HIROSHIMA UNIVERSITY (JP) 2009-01-01 US disclosed
CN-101103037-A Novel condensed polycyclic aromatic compound and use thereof NAT UNIVERSITY OF CORP HIROSHI (JP) 2008-01-09 CN disclosed
EP-1847544-A1 NOVEL CONDENSED POLYCYCLIC AROMATIC COMPOUND AND USE THEREOF National University of Corporation Hiroshima University (JP) 2007-10-24 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110024731-A1 NOVEL CONDENSED POLYCYCLIC AROMATIC COMPOUND AND USE THEREOF HCN4, HCN2, CTCF CRHBP 3747/4885CRHR2 1754/4885ALDH1A1 4045/4885
US-12552772-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD YAP1, TEAD3, TEAD2 CRHBP 3864/4885CRHR2 3996/4885ALDH1A1 1935/4885
US-11937499-B2 Aromatic amine derivative and organic electroluminescent devices containing the same TYR, DDC, AOC2 CRHBP 4496/4885CRHR2 4523/4885ALDH1A1 232/4885
US-20090001357-A1 Novel Condensed Polycyclic Aromatic Compound and Use Thereof HCN4, HCN2, CTCF CRHBP 3747/4885CRHR2 1754/4885ALDH1A1 4045/4885
US-12030866-B2 2-pyrazole anilines and related analogs for inhibiting YAP/TAZ-TEAD YAP1, TEAD3, TEAD2 CRHBP 3257/4885CRHR2 4282/4885ALDH1A1 2212/4885
US-20250115574-A1 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD YAP1, TEAD3, TEAD2 CRHBP 3257/4885CRHR2 4282/4885ALDH1A1 2212/4885
US-20250176429-A1 MATERIALS FOR ELECTRONIC DEVICES ETV6, ERCC1, EED CRHBP 3730/4885CRHR2 3554/4885ALDH1A1 503/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.