SCHEMBL1964014

SCHEMBL1964014

Cc1ccc(C)c(NC(=O)c2ccccc2N)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.71
HSD17B10 Q99714 3/20 0.71
LMNA P02545 3/20 0.71
TSHR P16473 1/20 0.71
ALDH1A1 P00352 4/20 0.66
KMT2A Q03164 2/20 0.66
MEN1 O00255 1/20 0.66
NPSR1 Q6W5P4 1/20 0.66
NPC1 O15118 6/20 0.57
KDM4E B2RXH2 4/20 0.57
CASP3 P42574 1/20 0.57
SENP8 Q96LD8 1/20 0.57
SENP7 Q9BQF6 1/20 0.57
SENP6 Q9GZR1 1/20 0.57
POLB P06746 3/20 0.56
MAOA P21397 1/20 0.55
MAOB P27338 1/20 0.55
HTT P42858 1/20 0.54
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52

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
SCHEMBL1962893 0.88 MAPT (0.66) RAB9AHSD17B10LMNATSHRALDH1A1
SCHEMBL865787 0.86 RAB9A (0.58) RAB9AHSD17B10LMNATSHRALDH1A1
SCHEMBL30932789 0.86 RAB9A (0.58) RAB9AHSD17B10LMNATSHRALDH1A1
SCHEMBL4642645 0.84 NPC1 (0.68) RAB9AHSD17B10LMNATSHRALDH1A1
SCHEMBL31606761 0.84 NPC1 (0.68) RAB9AHSD17B10LMNATSHRALDH1A1
SCHEMBL31462147 0.84 NPC1 (0.68) RAB9AHSD17B10LMNATSHRALDH1A1
SCHEMBL11400333 0.83 LMNA (1.00) RAB9AHSD17B10LMNATSHRALDH1A1
SCHEMBL7821474 0.83 NPSR1 (0.76) RAB9AHSD17B10LMNATSHRALDH1A1
SCHEMBL4511180 0.80 NPC1 (0.66) RAB9AHSD17B10LMNAALDH1A1NPC1
SCHEMBL11743614 0.78 NPC1 (0.72) RAB9AHSD17B10LMNAALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140155417-A1 COMPOUNDS FOR MODULATING TRPV3 FUNCTION HYDRA BIOSCIENCES, INC. (US) 2014-06-05 US disclosed
US-8552009-B2 Substituted pyrimido 4.5-d pyrimidin-4-one compounds for modulating TRPV3 function HYDRA BIOSCIENCES, INC. 2013-10-08 US disclosed
US-20110144135-A1 Compounds for Modulating TRPV3 Function HYDRA BIOSCIENCES, INC. (US) 2011-06-16 US disclosed
US-7893260-B2 Substituted quinazolin-4-one compounds for antagonizing TRPV3 function HYDRA BIOSCIENCES, INC. (US) 2011-02-22 US disclosed
US-20100152209-A1 Compounds for Modulating TRPV3 Function HYDRA BIOSCIENCES INC. (US) 2010-06-17 US disclosed
EP-1954283-A2 COMPOUNDS FOR MODULATING TRPV3 FUNCTION Hydra Biosciences, Inc. (US) 2008-08-13 EP disclosed
US-20070179164-A1 Compounds for modulating TRPV3 function HYDRA BIOSCIENCES, INC. (US) 2007-08-02 US disclosed
WO-2007056124-A2 COMPOUNDS FOR MODULATING TRPV3 FUNCTION HYDRA BIOSCIENCES, INC. (US) 2007-05-18 WO 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 (4 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-20140155417-A1 COMPOUNDS FOR MODULATING TRPV3 FUNCTION TRPV3, TRPV1, TRPV4 RAB9A 2695/4885HSD17B10 2713/4885LMNA 3054/4885
US-20100152209-A1 Compounds for Modulating TRPV3 Function TRPV3, TRPV1, TRPV4 RAB9A 2695/4885HSD17B10 2713/4885LMNA 3054/4885
US-20070179164-A1 Compounds for modulating TRPV3 function TRPV3, TRPV1, TRPV4 RAB9A 2695/4885HSD17B10 2713/4885LMNA 3054/4885
US-20110144135-A1 Compounds for Modulating TRPV3 Function TRPV3, TRPV1, TRPV4 RAB9A 2695/4885HSD17B10 2713/4885LMNA 3054/4885

“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.