SCHEMBL16363181

SCHEMBL16363181

Cc1ccc(C(F)(F)F)c(-c2ccc(NC(=O)c3cccnc3C)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 12/20 0.54
▸ IDO1 P14902 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ NPC1 O15118 1/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SENP8 Q96LD8 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP6 Q9GZR1 1/20 0.47
▸ S1PR1 P21453 2/20 0.46
▸ S1PR3 Q99500 2/20 0.46

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
SCHEMBL1828980 0.90 TRPV1 (0.57) TRPV1IDO1
SCHEMBL16363169 0.84 HPGD (0.52) KDM4ENPC1RAB9A
SCHEMBL16363171 0.83 LMNA (0.61) KDM4ENPC1RAB9A
SCHEMBL16363172 0.82 KCNK3 (0.47) TRPV1NPC1RAB9AS1PR1S1PR3
SCHEMBL16363156 0.81 IDO1 (0.47) TRPV1IDO1
SCHEMBL16363163 0.81 S1PR1 (0.59) NPC1RAB9AS1PR1
SCHEMBL16363175 0.81 KCNK3 (0.47) TRPV1IDO1S1PR1S1PR3
SCHEMBL16363178 0.81 NR2E1 (0.56) TRPV1KDM4ES1PR1S1PR3
SCHEMBL16363170 0.80 TRPV1 (0.44) TRPV1IDO1NPC1RAB9A
SCHEMBL16363174 0.80 PTGES (0.46) RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150005320-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2015-01-01 — — US disclosed
US-20140107134-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-04-17 — — 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 (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-20140107134-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCR2, CXCL8, CCR9 TRPV1 795/4885IDO1 249/4885KDM4E 2452/4885
US-20150005320-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCR2, CXCL8, CCR9 TRPV1 795/4885IDO1 249/4885KDM4E 2452/4885

“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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