SCHEMBL11071972

SCHEMBL11071972

CCCC(=O)c1ccc(N)c(C)c1C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
HPGD P15428 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HSD17B10 Q99714 2/20 0.43
ALOX15 P16050 1/20 0.43
RECQL P46063 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HSD17B3 P37058 1/20 0.40
FASN P49327 1/20 0.39
TCF4 P15884 1/20 0.38
CTNNB1 P35222 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 1/20 0.36
NOS2 P35228 1/20 0.36
STS P08842 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
SCHEMBL17420773 0.85 HSP90AB1 (0.44) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL7476851 0.84 HSD17B10 (0.46) TSHRHPGDALDH1A1HSD17B10ALOX15
SCHEMBL507731 0.81 TSHR (0.46) TSHRHPGDALDH1A1HSD17B10ALOX15
SCHEMBL6699177 0.80 FASN (0.41) HPGDALDH1A1RECQLTDP1HSD17B3
SCHEMBL11483328 0.77 HTT (0.44) ALDH1A1HSD17B10HSD17B3HTTSTS
SCHEMBL9559780 0.76 MAPT (0.49) TSHRHPGDALDH1A1HSD17B10ALOX15
SCHEMBL6232283 0.76 CYP3A4 (0.40) TSHRHPGDALDH1A1HSD17B10ALOX15
SCHEMBL6109740 0.75 PTGER4 (0.47) TSHRHPGDALDH1A1HSD17B10ALOX15
SCHEMBL11220438 0.75 ALDH1A1 (0.41) TSHRHPGDALDH1A1HSD17B10ALOX15
SCHEMBL55681 0.74 ALDH1A1 (0.61) TSHRHPGDALDH1A1HSD17B10ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4476132-A Acylquinolinone derivatives, and antiallergic preparations and methods of inhibiting allergic reactions using them CIBA-GEIGY CORPORATION (US) 1984-10-09 US disclosed
EP-0062001-A2 Acyl quinolinone derivatives, processes for their preparation, pharmaceutical compositions containing them and their use CIBA-GEIGY AG (CH) 1982-10-06 EP disclosed