SCHEMBL5927066

SCHEMBL5927066

CN(Cc1ccc(-c2ccccc2)cc1)C(CC(=O)O)NC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTTP P55157 5/20 0.49
▸ TMEM97 Q5BJF2 1/20 0.47
▸ SIGMAR1 Q99720 1/20 0.47
▸ LSS P48449 1/20 0.47
▸ HDAC1 Q13547 6/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MMP2 P08253 1/20 0.45
▸ MMP8 P22894 1/20 0.45
▸ MMP12 P39900 1/20 0.45
▸ ADAMTS5 Q9UNA0 1/20 0.45
▸ PPARG P37231 1/20 0.44
▸ HDAC3 O15379 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ MTOR P42345 1/20 0.44
▸ HDAC4 P56524 1/20 0.43

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
SCHEMBL5926183 0.91 MTTP (0.47) MTTPTMEM97SIGMAR1LSSHDAC1
SCHEMBL5927532 0.84 MMP13 (0.47) MTTPTMEM97SIGMAR1HDAC1PPARG
SCHEMBL5926234 0.80 NPC1 (0.50) MTTPTMEM97SIGMAR1HDAC1PPARG
SCHEMBL5927062 0.79 TMEM97 (0.54) MTTPTMEM97SIGMAR1LSSHDAC1
SCHEMBL5927274 0.79 HPGDS (0.50) MTTPADAMTS5HDAC2CYP3A4
SCHEMBL5926792 0.78 FFAR1 (0.47) MTTPMEN1KMT2AADAMTS5PPARG
SCHEMBL6100258 0.77 MMP13 (0.44) MTTPTMEM97SIGMAR1HDAC1MEN1
SCHEMBL5926180 0.77 TMEM97 (0.51) MTTPTMEM97SIGMAR1LSSHDAC1
SCHEMBL5926703 0.76 MTTP (0.49) MTTPHDAC1ADAMTS5PPARGHDAC3
SCHEMBL3991800 0.76 CTSA (0.56) CYP3A4

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 5 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
EP-1546089-A2 ARYL AND HETEROARYL COMPOUNDS AND METHODS TO MODULATE COAGULATION TransTech Pharma Inc. (US) 2005-06-29 — — EP 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
WO-2004014844-A2 ARYL AND HETEROARYL COMPOUNDS AND METHODS TO MODULATE COAGULATION TRANSTECH PHARMA, INC. (US) 2004-02-19 — — 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-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 MTTP 3028/4885TMEM97 3596/4885SIGMAR1 4740/4885
US-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TFPI, F9, F2 MTTP 1668/4885TMEM97 2892/4885SIGMAR1 4138/4885

“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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