SCHEMBL5927129

SCHEMBL5927129

O=C(N[C@@H](Cc1ccc(-c2ccccc2Oc2ccccc2)cc1)C(=O)O)c1cc(Cl)ccc1NCc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR34 Q9UPC5 9/20 0.57
▸ PTPN1 P18031 2/20 0.48
▸ GPR132 Q9UNW8 2/20 0.47
▸ KIFC1 Q9BW19 1/20 0.46
▸ KCNA3 P22001 1/20 0.45
▸ PPARG P37231 2/20 0.43
▸ ITGB1 P05556 1/20 0.43
▸ ITGA4 P13612 1/20 0.43
▸ ITGB7 P26010 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
SCHEMBL5927430 0.94 GPR34 (0.47) GPR34PTPN1ITGB1ITGA4ITGB7
SCHEMBL5926815 0.91 GPR34 (0.55) GPR34PTPN1GPR132KIFC1KCNA3
SCHEMBL5926964 0.91 GPR34 (0.55) GPR34PTPN1GPR132KIFC1KCNA3
SCHEMBL5926977 0.90 FFAR1 (0.45) GPR34KIFC1PPARGITGB1ITGA4
SCHEMBL5927134 0.88 KCNA3 (0.44) GPR34KCNA3
SCHEMBL5927210 0.88 ITGA4 (0.45) GPR34KIFC1ITGB1ITGA4ITGB7
SCHEMBL3993018 0.87 GPR132 (0.59) GPR34PTPN1GPR132KIFC1
SCHEMBL5926298 0.86 ITGA4 (0.47) GPR34ITGB1ITGA4ITGB7
SCHEMBL5927167 0.86 GPR132 (0.51) GPR34PTPN1GPR132PPARG
SCHEMBL5926541 0.86 KIFC1 (0.48) GPR34PTPN1GPR132KIFC1ITGB1

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
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 (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 GPR34 4272/4885PTPN1 2517/4885GPR132 3507/4885

“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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