SCHEMBL10249294

SCHEMBL10249294

Cc1ccc(NC(C)(C)C)c(N)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
ALOX15 P16050 2/20 0.48
CYP3A4 P08684 2/20 0.48
TP53 P04637 1/20 0.48
THRB P10828 1/20 0.48
ALDH1A1 P00352 3/20 0.46
APP P05067 1/20 0.46
HSD17B10 Q99714 1/20 0.43
HDAC6 Q9UBN7 1/20 0.42
CA1 P00915 1/20 0.42
SLC6A4 P31645 1/20 0.41
KDM4E B2RXH2 2/20 0.41
RAPGEF4 Q8WZA2 2/20 0.39
NPC1 O15118 2/20 0.37
RAB9A P51151 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
GFER P55789 1/20 0.37
IDO1 P14902 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
SCHEMBL6280097 0.81 HDAC6 (0.45) SMN1; SMN2TDP1ALOX15CYP3A4TP53
SCHEMBL8248081 0.78 RAPGEF4 (0.57) SMN1; SMN2TDP1TP53ALDH1A1HDAC6
SCHEMBL1957518 0.78 AAK1 (0.39) ALDH1A1KDM4EGAAMAPTIDO1
SCHEMBL24463592 0.78 IDO1 (0.35) SLC6A4IDO1
SCHEMBL16564658 0.76 PDE3B (0.44) SMN1; SMN2CYP3A4TP53ALDH1A1APP
SCHEMBL7262816 0.76 TDP1 (0.54) SMN1; SMN2TDP1ALOX15CYP3A4TP53
SCHEMBL14218921 0.76 TDP1 (0.54) SMN1; SMN2TDP1ALOX15CYP3A4TP53
SCHEMBL12403850 0.75 RAB9A (0.44) SMN1; SMN2TP53ALDH1A1KDM4ERAPGEF4
SCHEMBL19848688 0.75 RAPGEF4 (0.39) TDP1ALDH1A1KDM4ERAPGEF4GAA
SCHEMBL23092052 0.75 RAB9A (0.44) SMN1; SMN2TP53ALDH1A1KDM4ERAPGEF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3632897-A1 NOVEL BIPHENYL COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2020-04-08 EP disclosed
US-8461181-B2 Fused heterocyclic compound and use thereof SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2013-06-11 US disclosed
US-8273764-B2 Fused heterocyclic compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-25 US disclosed
US-20120178779-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED 2012-07-12 US disclosed
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 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-20120178779-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 SMN1; SMN2 1524/4885TDP1 3930/4885ALOX15 2102/4885
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 SMN1; SMN2 1524/4885TDP1 3930/4885ALOX15 2102/4885

“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.