SCHEMBL13287465

SCHEMBL13287465

C=C(C)Oc1c(/C=C/c2nc3ccccn3c2C(=O)Nc2nc(C(F)(F)F)cs2)cccc1OC(F)F

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
GPR139 Q6DWJ6 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
FFAR2 O15552 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
GRM5 P41594 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL13287388 0.92 MAPK1 (0.37) RAB9ANPC1TP53ALDH1A1HPGD
SCHEMBL13287382 0.89 RAB9A (0.37) RAB9ANPC1TP53GPR139ALDH1A1
SCHEMBL13287389 0.88 ADORA1 (0.36) RAB9ANPC1TP53GPR139ALDH1A1
SCHEMBL14038883 0.86 GPR139 (0.34) RAB9ANPC1TP53GPR139ALDH1A1
SCHEMBL13287390 0.86 ADORA1 (0.34) RAB9ANPC1TP53GPR139ALDH1A1
SCHEMBL13287367 0.84 NPC1 (0.37) RAB9ANPC1ALDH1A1HPGDLMNA
SCHEMBL13287357 0.82 FFAR2 (0.30) FFAR2
SCHEMBL13287397 0.82 NPC1 (0.36) RAB9ANPC1GPR139ALDH1A1LMNA
SCHEMBL13287337 0.81 MAPK1 (0.36) RAB9ANPC1TP53ALDH1A1HPGD
SCHEMBL13287376 0.80 CSNK2A2 (0.33) TP53ALDH1A1HPGDLMNASMN1; SMN2

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-20100152192-A1 FUSED IMIDAZOLE CARBOXAMIDES AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS S.A (CH) 2010-06-17 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-20100152192-A1 FUSED IMIDAZOLE CARBOXAMIDES AS TRPV3 MODULATORS TRPV3, TRPV1, TRPV2 RAB9A 2769/4885NPC1 744/4885TP53 4336/4885

“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.