SCHEMBL5926688

SCHEMBL5926688

Nc1ccc(Cl)cc1C(=O)NC(CC(=O)O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 5/20 0.58
▸ CYP26A1 O43174 2/20 0.53
▸ SUCNR1 Q9BXA5 2/20 0.49
▸ MMP12 P39900 3/20 0.48
▸ MMP3 P08254 1/20 0.48
▸ MMP9 P14780 1/20 0.48
▸ MMP8 P22894 1/20 0.48
▸ MMP13 P45452 1/20 0.48
▸ DCAF1 Q9Y4B6 3/20 0.48
▸ UTS2R Q9UKP6 4/20 0.47

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
SCHEMBL5926281 0.89 TACR3 (0.53) CTSACYP26A1DCAF1UTS2R
SCHEMBL5926664 0.86 CTSA (0.53) CTSACYP26A1MMP12MMP3MMP9
SCHEMBL3991451 0.86 CTSA (0.45) CTSACYP26A1MMP12DCAF1
SCHEMBL5926663 0.83 CTSA (0.53) CTSACYP26A1SUCNR1MMP12MMP3
SCHEMBL5926999 0.83 CTSA (0.61) CTSACYP26A1
SCHEMBL5927213 0.81 CTSA (0.52) CTSACYP26A1
SCHEMBL3989390 0.80 TACR3 (0.44) CTSADCAF1UTS2R
SCHEMBL5926681 0.80 ERAP1 (0.53) —
SCHEMBL5926540 0.78 CTSA (0.47) CTSACYP26A1SUCNR1MMP12UTS2R
SCHEMBL5927087 0.78 CYP26A1 (0.49) CTSACYP26A1UTS2R

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 CTSA 638/4885CYP26A1 2632/4885SUCNR1 4730/4885
US-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TFPI, F9, F2 CTSA 426/4885CYP26A1 526/4885SUCNR1 4563/4885

“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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