SCHEMBL7566278

SCHEMBL7566278

N#Cc1ccc(C(=O)O)c(C(F)(F)F)c1.NC(=O)c1ccc(C(=O)O)c(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P4HB P07237 2/20 0.46
▸ MRGPRX4 Q96LA9 1/20 0.46
▸ TRPV4 Q9HBA0 1/20 0.43
▸ PARP15 Q460N3 1/20 0.43
▸ PARP10 Q53GL7 1/20 0.43
▸ PARP2 Q9UGN5 1/20 0.43
▸ XDH P47989 3/20 0.41
▸ SLC22A12 Q96S37 3/20 0.41
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ SLC9A1 P19634 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ TMPRSS4 Q9NRS4 1/20 0.40
▸ MAP2K1 Q02750 1/20 0.39
▸ TAS2R14 Q9NYV8 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL1417702 0.88 TRPV4 (0.53) P4HBMRGPRX4TRPV4XDHSLC22A12
SCHEMBL7561075 0.87 KDM4E (0.47) TAS2R14KDM4EALDH1A1HPGDHSD17B10
SCHEMBL8612254 0.85 TRPV4 (0.50) P4HBMRGPRX4TRPV4PARP15PARP10
SCHEMBL2425056 0.78 CES2 (0.47) CYP3A4CYP2C9SLC9A1CYP2C19VNN1
SCHEMBL8805711 0.78 PARP15 (0.46) PARP15PARP10PARP2XDHSLC22A12
SCHEMBL23370123 0.76 TRPV4 (0.50) P4HBMRGPRX4TRPV4XDHSLC22A12
SCHEMBL2637596 0.76 AR (0.53) TAS2R14
SCHEMBL15855788 0.76 CES2 (0.44) P4HBMRGPRX4KDM4EALDH1A1HPGD
SCHEMBL7026695 0.75 CES2 (0.50) P4HBKDM4EALDH1A1HPGDHSD17B10
SCHEMBL1787904 0.75 AKR1C3 (0.56) P4HBMRGPRX4TRPV4CYP2C9ATIC

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-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 — — 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-20020151534-A1 Antithrombotic compounds SERPINC1, PF4, F2 P4HB 1108/4885MRGPRX4 2050/4885TRPV4 1849/4885

“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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