SCHEMBL16363159

SCHEMBL16363159

Cc1ccc(C(F)(F)F)c(-c2ccc(NC(=O)c3snnc3C)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPC3 Q13507 1/20 0.54
▸ ORAI1 Q96D31 1/20 0.54
▸ TRPC5 Q9UL62 1/20 0.54
▸ LMNA P02545 2/20 0.54
▸ ALDH1A1 P00352 2/20 0.52
▸ CRACR2A Q9BSW2 5/20 0.50
▸ POLB P06746 2/20 0.46
▸ GAA P10253 3/20 0.44
▸ AGTR1 P30556 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ USP2 O75604 1/20 0.42
▸ TRPV1 Q8NER1 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42

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
SCHEMBL1827030 0.90 POLB (0.54) TRPC3ORAI1TRPC5LMNAALDH1A1
SCHEMBL16363160 0.83 LMNA (0.57) TRPC3ORAI1TRPC5LMNAALDH1A1
SCHEMBL16363187 0.81 LMNA (0.55) TRPC3ORAI1TRPC5LMNAALDH1A1
SCHEMBL8297610 0.80 POLB (0.55) TRPC3ORAI1TRPC5LMNAALDH1A1
SCHEMBL16363166 0.80 LMNA (0.54) LMNAALDH1A1POLBGAAMEN1
SCHEMBL6621449 0.79 LMNA (0.77) TRPC3ORAI1TRPC5LMNAALDH1A1
SCHEMBL1826606 0.79 IL2 (0.58) TRPC3ORAI1TRPC5LMNAALDH1A1
SCHEMBL7972108 0.78 LMNA (0.84) TRPC3ORAI1TRPC5LMNAALDH1A1
SCHEMBL16363167 0.76 GFER (0.53) ALDH1A1CRACR2AGAAMEN1KMT2A
SCHEMBL16363170 0.76 TRPV1 (0.44) LMNAAGTR1MEN1KMT2ATRPV1

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 TRPC3 2002/4885ORAI1 1379/4885TRPC5 2164/4885
US-20150005320-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCR2, CXCL8, CCR9 TRPC3 2002/4885ORAI1 1379/4885TRPC5 2164/4885

“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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