SCHEMBL5926596

SCHEMBL5926596

CC(C)(C)c1ccc(CNc2ccc(Oc3cccc(C(F)(F)F)c3)cc2C(=O)NC(CC(=O)O)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 4/20 0.42
▸ FFAR1 O14842 2/20 0.41
▸ MAPK14 Q16539 2/20 0.41
▸ GPR34 Q9UPC5 1/20 0.41
▸ CYP26A1 O43174 3/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ KIFC1 Q9BW19 1/20 0.40
▸ KCNQ3 O43525 1/20 0.40
▸ KCNQ2 O43526 1/20 0.40
▸ MMP12 P39900 1/20 0.39
▸ EEF2K O00418 1/20 0.39

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
SCHEMBL5926591 0.88 KIFC1 (0.53) MAPK14GPR34RXFP1KIFC1
SCHEMBL5926247 0.88 CYP26A1 (0.48) CTSACYP26A1
SCHEMBL5927140 0.88 CYP26A1 (0.46) CTSAFFAR1CYP26A1RXFP1
SCHEMBL5927463 0.87 CYP26A1 (0.42) CTSACYP26A1MMP12
SCHEMBL5926736 0.87 POLB (0.43) CTSACYP26A1
SCHEMBL5926345 0.86 CYP26A1 (0.42) CTSAFFAR1CYP26A1MMP12
SCHEMBL5927339 0.84 CTSA (0.43) CTSACYP26A1RXFP1
SCHEMBL5926381 0.83 IGF2BP2 (0.48) FFAR1CYP26A1MMP12EEF2K
SCHEMBL5927217 0.79 CTSA (0.47) CTSAFFAR1CYP26A1RXFP1KIFC1
SCHEMBL5926181 0.79 IGF2BP2 (0.52) CTSAFFAR1MAPK14MMP12

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 1 patent. 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TFPI, F9, F2 CTSA 426/4885FFAR1 1360/4885MAPK14 3787/4885

“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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