SCHEMBL5987698

SCHEMBL5987698

Cc1ccc2c(c1)N(C)C(=O)N(C)C2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.44
PKM P14618 2/20 0.42
BRD4 O60885 2/20 0.42
BRD2 P25440 1/20 0.42
BRD3 Q15059 1/20 0.42
AADAT Q8N5Z0 2/20 0.40
ALDH1A1 P00352 4/20 0.38
SRD5A1 P18405 1/20 0.36
KDM4E B2RXH2 1/20 0.35
F2 P00734 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
METAP1 P53582 2/20 0.35
ACHE P22303 1/20 0.35
CNR1 P21554 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
MAPT P10636 2/20 0.35
PARP1 P09874 1/20 0.34
PARP10 Q53GL7 1/20 0.34

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
SCHEMBL5985150 0.86 BRD4 (0.51) HSD17B10PKMBRD4BRD2BRD3
SCHEMBL31173196 0.81 BRD4 (0.49) BRD4BRD2BRD3ALDH1A1SRD5A1
SCHEMBL22290464 0.81 BRD4 (0.49) BRD4BRD2BRD3ALDH1A1SRD5A1
SCHEMBL30343045 0.77 LMNA (0.48) HSD17B10BRD4BRD2BRD3ALDH1A1
SCHEMBL21932295 0.77 LMNA (0.48) HSD17B10BRD4BRD2BRD3ALDH1A1
SCHEMBL3525035 0.76 BRD4 (0.47) BRD4BRD2BRD3ALDH1A1KDM4E
SCHEMBL5986263 0.74 HSD17B10 (0.47) HSD17B10PKMAADATALDH1A1SRD5A1
SCHEMBL5023390 0.73 SRD5A1 (0.54) HSD17B10BRD4AADATALDH1A1SRD5A1
SCHEMBL5986161 0.72 BRD4 (0.41) PKMBRD4BRD2BRD3
SCHEMBL19508032 0.72 FGFR4 (0.37) PKMBRD4BRD2BRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed
US-8658639-B2 N-substituted-cyclic amino derivative DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-02-25 US disclosed
US-8658639-B2 N-substituted-cyclic amino derivative DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-02-25 US disclosed
US-8389511-B2 Bicyclic heterocyclic derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-03-05 US disclosed
US-8389511-B2 Bicyclic heterocyclic derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-03-05 US disclosed
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-17 US disclosed
EP-2447264-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-05-02 EP disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 US disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 US disclosed
WO-2010150840-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE 大日本住友製薬株式会社 (JP) 2010-12-29 WO disclosed
EP-2243779-A1 BICYCLIC HETEROCYCLIC DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2010-10-27 EP 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-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE REN, AGTR1, AGTR2 HSD17B10 566/4885PKM 1308/4885BRD4 67/4885
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE REN, AGTR1, AGTR2 HSD17B10 976/4885PKM 1486/4885BRD4 243/4885

“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.