SCHEMBL2925384

SCHEMBL2925384

CC(C)(C)OC(=O)N1CCN(c2cc3[nH]c(N[C@H]4C[C@H]5CC[C@H]4C5)nc3cc2C(=O)Nc2ccc3cn[nH]c3c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 11/20 0.42
NAMPT P43490 1/20 0.42
LMNA P02545 4/20 0.40
USP2 O75604 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PTPN11 Q06124 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL2925381 1.00 TRPV1 (0.42) TRPV1NAMPTLMNAUSP2MAPK1
SCHEMBL13086198 1.00 TRPV1 (0.42) TRPV1NAMPTLMNAUSP2MAPK1
SCHEMBL2930483 0.90 TRPV1 (0.44) TRPV1LMNAUSP2MAPK1HSD17B10
SCHEMBL13086201 0.88 LMNA (0.42) TRPV1LMNAUSP2MAPK1HSD17B10
SCHEMBL2930761 0.81 TRPV1 (0.39) TRPV1NAMPTLMNAUSP2MAPK1
SCHEMBL2929864 0.81 TRPV1 (0.47) TRPV1NAMPTNPC1RAB9APTPN11
SCHEMBL2928663 0.81 TRPV1 (0.52) TRPV1NAMPTLMNAUSP2MAPK1
SCHEMBL13086063 0.81 HPGD (0.47) TRPV1LMNAUSP2MAPK1HSD17B10
SCHEMBL2928749 0.79 TRPV1 (0.52) TRPV1NAMPTLMNAUSP2MAPK1
SCHEMBL2930123 0.74 TRPV1 (0.47) TRPV1NAMPTLMNAUSP2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377983-B2 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors TRANSTECH PHARMA, INC. (US) 2013-02-19 US disclosed
US-7820821-B2 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors TRANSTECH PHARMA, INC. (US) 2010-10-26 US disclosed
US-20100152170-A1 Benzazole Derivatives, Compositions, And Methods Of Use As Aurora Kinase Inhibitors TRANSTECH PHARMA, INC. (US) 2010-06-17 US disclosed
US-20070219235-A1 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors VTVX HOLDINGS I LLC 2007-09-20 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-20100152170-A1 Benzazole Derivatives, Compositions, And Methods Of Use As Aurora Kinase Inhibitors AURKC, AURKA, AURKB TRPV1 3399/4885NAMPT 1387/4885LMNA 1520/4885
US-20070219235-A1 Benzazole derivatives, compositions, and methods of use as aurora kinase inhibitors AURKC, AURKA, AURKB TRPV1 3399/4885NAMPT 1387/4885LMNA 1520/4885

“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.