SCHEMBL17795214

SCHEMBL17795214

Cc1ccc(-c2cccc(C(=O)N(C)C)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.60
HSD17B1 P14061 2/20 0.51
HSD17B2 P37059 2/20 0.51
DHODH Q02127 2/20 0.51
PDK2 Q15119 1/20 0.51
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
HDAC6 Q9UBN7 1/20 0.48
CYP3A4 P08684 1/20 0.47
MAP4K1 Q92918 1/20 0.47
UTS2R Q9UKP6 1/20 0.46
GFER P55789 1/20 0.46
KMO O15229 1/20 0.46

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
SCHEMBL30283775 0.87 ERN1 (0.60) ERN1HSD17B1HSD17B2PDK2LMNA
SCHEMBL1135975 0.87 ERN1 (0.60) ERN1HSD17B1HSD17B2PDK2LMNA
SCHEMBL18311613 0.86 ERN1 (0.64) ERN1HSD17B1HSD17B2PDK2LMNA
Hydrochloric Acid SCHEMBL28646857 0.86 ERN1 (0.59) ERN1HSD17B1HSD17B2PDK2LMNA
SCHEMBL12168605 0.85 ERN1 (0.58) ERN1PDK2LMNAHDAC6KMO
SCHEMBL13680496 0.83 HSD17B2 (0.72) ERN1HSD17B1HSD17B2PDK2LMNA
SCHEMBL20057645 0.82 HPGD (0.72) ERN1HSD17B2LMNAHPGDTSHR
SCHEMBL19567237 0.82 ERN1 (0.56) ERN1HSD17B1HSD17B2PDK2LMNA
SCHEMBL19369002 0.82 ERN1 (0.56) ERN1HSD17B1HSD17B2PDK2LMNA
SCHEMBL17806554 0.82 ERN1 (0.56) ERN1HSD17B1HSD17B2DHODHPDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3224258-B1 4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH INC (US) 2019-08-14 EP disclosed
WO-2016086200-A9 4,5,6,7-TETRAHYDRO-1 H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH, INC. (US) 2016-06-23 WO disclosed
WO-2016086200-A1 4,5,6,7-TETRAHYDRO-1 H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH, INC. (US) 2016-06-02 WO disclosed