SCHEMBL66941

SCHEMBL66941

Brc1cccc(Br)c1-c1ccccc1-c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.65
MAPK1 P28482 3/20 0.65
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
BCL2L1 Q07817 1/20 0.41
CYP2A6 P11509 1/20 0.41
HNF4A P41235 1/20 0.41
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
FABP4 P15090 1/20 0.40

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
SCHEMBL7525871 0.86 ALDH1A1 (0.65) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
SCHEMBL31512410 0.86 ALDH1A1 (0.65) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
SCHEMBL8158458 0.86 ALDH1A1 (0.54) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
SCHEMBL26191582 0.86 ALDH1A1 (0.54) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
Water SCHEMBL29289411 0.84 ALDH1A1 (0.62) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
SCHEMBL1768510 0.84 ALDH1A1 (0.70) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
SCHEMBL29213644 0.82 ALDH1A1 (0.94) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
SCHEMBL27901709 0.80 ALDH1A1 (0.52) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
SCHEMBL4137802 0.80 ALDH1A1 (0.80) ALDH1A1MAPK1HSD17B10HPGDBCL2L1
SCHEMBL31115172 0.80 ALDH1A1 (0.80) ALDH1A1MAPK1HSD17B10HPGDBCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114685351-B OLED main body material based on triptycene framework and preparation method and application thereof 中国科学院化学研究所 2023-04-18 CN claimed
CN-114685351-A OLED main body material based on triptycene framework and preparation method and application thereof 中国科学院化学研究所 2022-07-01 CN claimed
US-20090149675-A1 PROCESS FOR THE PREPARATION OF ARYL-DIAMINES XEROX CORPORATION (US) 2009-06-11 US claimed
US-7544842-B1 Process for the preparation of aryl-diamines XEROX CORPORATION (US) 2009-06-09 US claimed
EP-4638547-A1 AROMATIC POLYMER, PROCESS FOR PRODUCING A POLYMER, MEMBRANE AND USE OF A MEMBRANE Forschungszentrum Jülich GmbH (DE) 2025-10-29 EP disclosed
EP-3527600-B1 ISOCYANATE COMPOSITION AND PRODUCTION METHOD FOR ISOCYANATE POLYMER ASAHI CHEMICAL IND (JP) 2025-07-09 EP disclosed
CN-116836033-A Improved ullmann coupling method 北京理工大学 2023-10-03 CN disclosed
US-11751472-B2 Aromatic amine derivative and elecroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2023-09-05 US disclosed
CN-115260490-B Electron donor-acceptor two-dimensional conjugated organic framework material and preparation method and application thereof 井冈山大学 2023-07-25 CN disclosed
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-04-13 US disclosed
US-11548975-B2 Isocyanate composition and method for producing isocyanate polymer ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-01-10 US disclosed
US-11538997-B2 Aromatic amine derivative and electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2022-12-27 US disclosed
EP-1520846-B1 Method for producing polymerized hydrocarbon JFE CHEMICAL CORP (JP) 2008-03-05 EP disclosed
US-20070278938-A1 AROMATIC AMINE DERIVATIVE AND ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-12-06 US disclosed
US-7138484-B2 Method for producing polymerized hydrocarbon JFE CHEMICAL CORPORATION (JP) 2006-11-21 US disclosed
US-20050075478-A1 Method for producing polymerized hydrocarbon JFE CHEMICAL CORPORATION (JP) 2005-04-07 US disclosed
EP-1520846-A1 Method for producing polymerized hydrocarbon JFE Chemical Corporation (JP) 2005-04-06 EP disclosed
US-6706850-B2 AROMATIC BLOCKS WITH BRANCHES OF ALIPHATIC POLYETHER CHAINS THAT HAVE LOWER THERMAL DECOMPOSITION TEMPERATURE FOR FORMATION OF POROUS ORGANIC FILMS THAT ALLOW LOWERING OF DIELECTRIC CONSTANT AS INSULATION MATERIALS IN ELECTRONICS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-03-16 US disclosed
US-20020006999-A1 Polyether copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-17 US disclosed
US-5064569-A Liquid crystals, chirally tilted, phenyl carboxylates MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-11-12 US 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 (6 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-11548975-B2 Isocyanate composition and method for producing isocyanate polymer IDH3A, IDH2, IDH3B ALDH1A1 643/4885MAPK1 2250/4885HSD17B10 386/4885
US-20070278938-A1 AROMATIC AMINE DERIVATIVE AND ELECTROLUMINESCENCE DEVICE USING THE SAME MAOA, SETD1A, EML4 ALDH1A1 351/4885MAPK1 1836/4885HSD17B10 4115/4885
US-20090149675-A1 PROCESS FOR THE PREPARATION OF ARYL-DIAMINES DDT, DDC, HDHD5 ALDH1A1 147/4885MAPK1 1553/4885HSD17B10 570/4885
US-11751472-B2 Aromatic amine derivative and elecroluminescence device using the same ALK, ALKBH3, ACVRL1 ALDH1A1 177/4885MAPK1 2476/4885HSD17B10 3498/4885
US-11538997-B2 Aromatic amine derivative and electroluminescence device using the same EML4, DDC, TYR ALDH1A1 470/4885MAPK1 1977/4885HSD17B10 3881/4885
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER IDH3A, IDH2, IDH3B ALDH1A1 666/4885MAPK1 2100/4885HSD17B10 331/4885

“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.