SCHEMBL30367690

SCHEMBL30367690

COc1ccc(CNc2nccc3c2c(Br)nn3C2CCN(C(=O)C(C)C)CC2)c(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ DPP7 Q9UHL4 1/20 0.40
▸ BTK Q06187 2/20 0.39
▸ PDE9A O76083 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ CYP1A2 P05177 4/20 0.37
▸ CYP3A4 P08684 4/20 0.37
▸ CYP2C19 P33261 4/20 0.37
▸ CYP2D6 P10635 2/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CLK4 Q9HAZ1 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ USP2 O75604 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ RAB9A P51151 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
SCHEMBL21903524 0.89 EPHX2 (0.44) KMT2ABTKPDE9ALMNAMAPT
SCHEMBL30499571 0.87 EGFR (0.40) KMT2ADPP7BTKPDE9ALMNA
SCHEMBL25272167 0.86 BTK (0.46) KMT2ABTKPDE9ALMNAMAPT
SCHEMBL20645215 0.86 PDE9A (0.48) KMT2APDE9ALMNAMAPTCYP1A2
SCHEMBL21903644 0.85 KMT2A (0.42) KMT2ADPP7BTKPDE9ALMNA
SCHEMBL21903640 0.85 KMT2A (0.42) KMT2ADPP7BTKPDE9ALMNA
SCHEMBL21903828 0.85 KMT2A (0.42) KMT2ADPP7BTKPDE9ALMNA
SCHEMBL25272291 0.84 CYP1A2 (0.41) KMT2APDE9ALMNAMAPTCYP1A2
SCHEMBL22010140 0.84 PDE9A (0.42) KMT2APDE9ALMNAMAPTCYP1A2
SCHEMBL30367510 0.84 BTK (0.41) KMT2ADPP7BTK

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
CN-116437918-A Pyrazolopyridine compounds as TAM inhibitors 上海德琪医药科技有限公司 2023-07-14 — — CN disclosed
WO-2023051464-A1 PYRAZOLOPYRIDINE COMPOUNDS AS TAM INHIBITORS SHANGHAI ANTENGENE CORPORATION LIMITED (CN) 2023-04-06 — — WO disclosed
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