SCHEMBL30367277

SCHEMBL30367277

CCOC(=O)c1nnn2cc(Br)cc(Cl)c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.43
TP53 P04637 2/20 0.43
ALOX12 P18054 1/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
CA9 Q16790 2/20 0.43
SLC5A1 P13866 2/20 0.42
SLC5A2 P31639 2/20 0.42
GLP1R P43220 1/20 0.41
GABRA2 P47869 1/20 0.41
GABRB2 P47870 1/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.40
XBP1 P17861 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL30710766 0.76 CYP19A1 (0.49) CYP19A1TP53ALOX12CA1CA2
SCHEMBL31258781 0.73 WDR5 (0.41) CYP19A1TP53GABRA2GABRB2MAPT
SCHEMBL18372519 0.71 CYP19A1 (0.47) CYP19A1TP53ALOX12CA1CA2
SCHEMBL16303616 0.71 TP53 (0.51) CYP19A1TP53ALOX12CA1CA2
SCHEMBL17362509 0.71 HSD17B10 (0.49) TP53GLP1RGABRA2GABRB2MAPT
SCHEMBL16983065 0.70 ALDH1A1 (0.44) TP53CA1CA2MAPTALDH1A1
SCHEMBL27389813 0.69 WDR5 (0.41) TP53GABRA2GABRB2MAPTALDH1A1
SCHEMBL21407529 0.68 TP53 (0.53) CYP19A1TP53ALOX12CA1CA2
SCHEMBL27080649 0.67 KMT2A (0.44) CA1CA2CA9GABRA2GABRB2
SCHEMBL29267273 0.67 IDO1 (0.42) TP53GABRA2GABRB2MAPTALDH1A1

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
WO-2023155886-A1 PYRAZOLOPYRIDINE COMPOUNDS AS TAM INHIBITORS SHANGHAI ANTENGENE CORPORATION LIMITED (CN) 2023-08-24 WO disclosed
WO-2023051464-A1 PYRAZOLOPYRIDINE COMPOUNDS AS TAM INHIBITORS SHANGHAI ANTENGENE CORPORATION LIMITED (CN) 2023-04-06 WO disclosed