SCHEMBL753210

SCHEMBL753210

Brc1ccc(-c2ccccn2)s1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.72
NPC1 O15118 8/20 0.72
RAB9A P51151 8/20 0.72
MAPT P10636 6/20 0.72
GLA P06280 2/20 0.72
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HDAC5 Q9UQL6 1/20 0.54
LMNA P02545 5/20 0.52
POLB P06746 2/20 0.52
CCR1 P32246 2/20 0.52
CCR5 P51681 2/20 0.52

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
SCHEMBL3069800 0.84 KDM4E (1.00) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL1771878 0.83 KDM4E (0.50) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL28857293 0.82 KDM4E (0.95) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL7865703 0.78 HDAC1 (0.52) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL146382 0.77 KDM4E (0.75) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL10960575 0.75 KDM4E (0.72) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL20382465 0.75 KDM4E (0.72) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL21258329 0.75 KDM4E (0.72) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL3847476 0.75 KDM4E (0.72) KDM4ENPC1RAB9AMAPTGLA
SCHEMBL3827117 0.75 KDM4E (0.72) KDM4ENPC1RAB9AMAPTGLA

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-113801170-A Bromine atom modified blue light absorption enhanced iridium (III) complex and preparation method thereof 东莞理工学院 2021-12-17 CN claimed
US-6605707-B1 Etherification; reacting erythromycin derivative with propargyl derivative and alkali alkoxide; reacting with acid and sodium nitrite ABBOTT LABORATORIES 2003-08-12 US claimed
EP-1265909-A2 PROCESS FOR THE PREPARATION OF 6-O-PROPARGYL ERYTHROMYCIN DERIVATIVES ABBOTT LABORATORIES (US) 2002-12-18 EP claimed
WO-2001077134-A2 PROCESS FOR THE PREPARATION OF 6-O-PROPARGYL ERYTHROMYCIN DERIVATIVES ABBOTT LABORATORIES (US) 2001-10-18 WO claimed
CN-118894889-A Platinum (II) complex material with self-photosensitive catalysis and preparation method and application thereof 东莞理工学院 2024-11-05 CN disclosed
US-20230303573-A1 3-((Hetero-)Aryl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives Grünenthal GmbH (DE) 2023-09-28 US disclosed
CN-112074507-B Compounds as Antibiotics 山东亨利医药科技有限责任公司 2023-09-05 CN disclosed
CN-113801170-A Bromine atom modified blue light absorption enhanced iridium (III) complex and preparation method thereof 东莞理工学院 2021-12-17 CN disclosed
CN-108602834-B Bruton's tyrosine kinase inhibitor 北京盛诺基医药科技股份有限公司 2021-01-08 CN disclosed
US-20200392096-A1 COMPOUND ACTING AS ANTIBIOTICS KBP BIOSCIENCES CO., LTD. (CN) 2020-12-17 US disclosed
US-20200392096-A1 COMPOUND ACTING AS ANTIBIOTICS KBP BIOSCIENCES CO., LTD. (CN) 2020-12-17 US disclosed
EP-3750881-A1 COMPOUND ACTING AS ANTIBIOTICS KBP Biosciences Co., Ltd. (CN) 2020-12-16 EP disclosed
WO-2000055168-A1 6-O-SUBSTITUTED MACROLIDES HAVING ANTIBACTERIAL ACTIVITY ABBOTT LABORATORIES (US) 2000-09-21 WO disclosed
US-6054435-A 6-O-substituted macrolides having antibacterial activity ABBOTT LABORATORIES (US) 2000-04-25 US disclosed
WO-1999043285-A2 SULPHONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1999-09-02 WO disclosed
EP-0937708-A2 sulphonamide derivatives ELI LILLY AND COMPANY (US) 1999-08-25 EP disclosed
US-5260294-A Treatment of diseases caused by oxidative metabolism of arachidonic acid; antiinflammatory, antiallergins, antiarthriric HOFFMAN-LA ROCHE INC. (US) 1993-11-09 US disclosed
US-5132310-A Benzochroman compounds, lipoxygenase inhibitors HOFFMANN-LA ROCHE INC. (US) 1992-07-21 US disclosed
US-5015661-A Lipoxygenase inhibitors HOFFMANN-LA ROCHE INC. (US) 1991-05-14 US disclosed
EP-0354508-A2 Benzopyranol derivatives F. HOFFMANN-LA ROCHE AG (CH) 1990-02-14 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 (2 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-20230303573-A1 3-((Hetero-)Aryl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives OPRK1, OPRD1, OPRL1 KDM4E 2919/4885NPC1 2990/4885RAB9A 3308/4885
US-20200392096-A1 COMPOUND ACTING AS ANTIBIOTICS PEPD, NRDC, DPP4 KDM4E 1834/4885NPC1 277/4885RAB9A 610/4885

“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.