SCHEMBL5927665

SCHEMBL5927665

COC(=O)CC(NC(=O)c1cc(Br)ccc1O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ TACR3 P29371 2/20 0.53
▸ HPGD P15428 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ ROCK2 O75116 2/20 0.43
▸ ROCK1 Q13464 2/20 0.43
▸ DCAF1 Q9Y4B6 3/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CTSA P10619 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 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
SCHEMBL4824874 0.93 POLB (0.49) POLBMEN1KMT2ATACR3HPGD
SCHEMBL3972848 0.88 POLB (0.53) POLBMEN1KMT2ATACR3ALDH1A1
SCHEMBL3992792 0.87 POLB (0.46) POLBMEN1KMT2ATACR3HPGD
SCHEMBL5926314 0.86 MEN1 (0.53) MEN1KMT2ATACR3HPGDALDH1A1
SCHEMBL5926460 0.86 TACR3 (0.53) POLBMEN1KMT2ATACR3HPGD
SCHEMBL5926559 0.84 TACR3 (0.51) POLBTACR3HPGDALDH1A1LMNA
SCHEMBL5926760 0.84 TACR3 (0.51) POLBMEN1KMT2ATACR3HPGD
SCHEMBL5927319 0.84 TACR3 (0.51) POLBMEN1KMT2ATACR3HPGD
SCHEMBL5927088 0.84 TACR3 (0.51) POLBMEN1KMT2ATACR3HPGD
SCHEMBL5927335 0.84 TACR3 (0.51) POLBMEN1KMT2ATACR3HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. 2006-12-07 — — US disclosed
US-7122580-B2 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. (US) 2006-10-17 — — US disclosed
US-20040110832-A1 management, treatment and/or control of diseases caused in intrinsic clotting pathway utilizing factor IX such as stroke, myocardial infarction, aneurysm surgery, and deep vein thrombosis associated with surgical procedures etc TRANSTECH PHARMA, LLC 2004-06-10 — — 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 (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-20040110832-A1 management, treatment and/or control of diseases caused in intrinsic clotting pathway utilizing factor IX such as stroke, myocardial infarction, aneurysm surgery, and deep vein thrombosis associated with surgical procedures etc TFPI, F9, TFPI2 POLB 3571/4885MEN1 1372/4885KMT2A 3655/4885
US-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TFPI, F9, F2 POLB 3935/4885MEN1 3448/4885KMT2A 2112/4885

“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.

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