SCHEMBL6628232

SCHEMBL6628232

Cc1cc(CCl)c2cc(F)ccc2n1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
HSD17B10 Q99714 2/20 0.46
ALDH1A1 P00352 3/20 0.43
GAA P10253 2/20 0.41
ATM Q13315 1/20 0.41
LMNA P02545 1/20 0.41
CASP3 P42574 1/20 0.41
MPO P05164 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GPR35 Q9HC97 1/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
CHRM4 P08173 1/20 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
Hydrochloric Acid SCHEMBL3768853 0.98 KDM4E (0.45) KDM4EHSD17B10ALDH1A1GAAATM
SCHEMBL13059432 0.85 KDM4E (0.47) KDM4EHSD17B10ALDH1A1GAAATM
SCHEMBL3881237 0.83 ALDH1A1 (0.47) KDM4EHSD17B10ALDH1A1GAAATM
SCHEMBL6628180 0.83 LMNA (0.61) KDM4EHSD17B10ALDH1A1LMNASMN1; SMN2
SCHEMBL6628522 0.81 POLB (0.50) KDM4EALDH1A1LMNAMPOSMN1; SMN2
Hydrochloric Acid SCHEMBL3879797 0.81 LMNA (0.59) KDM4EALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL25820060 0.81 GAA (0.45) KDM4EHSD17B10ALDH1A1GAAATM
Hydrochloric Acid SCHEMBL3770405 0.80 POLB (0.49) KDM4EALDH1A1LMNAMPOSMN1; SMN2
SCHEMBL994597 0.79 CYP1A2 (0.60) KDM4EALDH1A1SMN1; SMN2KMT2AHTT
SCHEMBL6627791 0.78 KDM4E (0.56) KDM4EHSD17B10ALDH1A1ATMLMNA

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100311741-A1 Bicyclosulfonyl Acid (BCSA) Compounds and Their Use as Therapeutic Agents INHIBOX LTD. (GB) 2010-12-09 US disclosed
US-20100311741-A1 Bicyclosulfonyl Acid (BCSA) Compounds and Their Use as Therapeutic Agents INHIBOX LTD. (GB) 2010-12-09 US disclosed
WO-2008142376-A1 BICYCLOSULFONYL ACID (BCSA) COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS INHIBOX LTD. (GB) 2008-11-27 WO disclosed
EP-1027332-B1 NOVEL LACTAM METALLOPROTEASE INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2004-05-26 EP disclosed
US-6610731-B2 Antiinflammatory BRISTOL-MYERS SQUIBB COMPANY 2003-08-26 US disclosed
US-20030134827-A1 Novel lactam metalloprotease inhibitors DUAN JINGWU (US) 2003-07-17 US disclosed
US-6403632-B1 CYCLIC AMIDE DERIVATIVE BRISTOL MYERS SQUIBB PHARMA CO (US) 2002-06-11 US disclosed
EP-1027332-A1 NOVEL LACTAM METALLOPROTEASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2000-08-16 EP disclosed
US-6057336-A ANTIINFLAMMATORY AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-02 US disclosed
WO-1999018074-A1 NOVEL LACTAM METALLOPROTEASE INHIBITORS Britol-Myers Squibb Pharma Company (US) 1999-04-15 WO 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-20100311741-A1 Bicyclosulfonyl Acid (BCSA) Compounds and Their Use as Therapeutic Agents TNF, CS, COASY KDM4E 3812/4885HSD17B10 835/4885ALDH1A1 1941/4885
US-20030134827-A1 Novel lactam metalloprotease inhibitors ADAM9, ADAM8, ADAM17 KDM4E 1715/4885HSD17B10 714/4885ALDH1A1 1466/4885

“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.