SCHEMBL30499514

SCHEMBL30499514

COc1ccc(CNc2nccc3c2c(-c2ccc(-c4c(C(N)=O)c(=O)n(-c5ccccn5)c(=O)n4C(C)C)cc2)nn3C2CCN3C(=O)CCC3C2)c(OC)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ EGFR P00533 2/20 0.32
▸ ZAP70 P43403 1/20 0.32
▸ KARS1 Q15046 1/20 0.32
▸ NR3C2 P08235 1/20 0.31
▸ F10 P00742 1/20 0.31
▸ BTK Q06187 3/20 0.31
▸ DGAT2 Q96PD7 1/20 0.30
▸ EPHX2 P34913 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL30367531 0.85 TYRO3 (0.43) —
SCHEMBL30499546 0.84 RET (0.34) BTKKDM4EHSD17B10
SCHEMBL30499566 0.84 TYRO3 (0.35) POLBMAPTEGFRNR3C2BTK
SCHEMBL30367391 0.75 PDE9A (0.38) MAPTBTKALDH1A1CYP1A2CYP3A4
SCHEMBL29052497 0.74 TYRO3 (0.52) —
SCHEMBL30499553 0.73 TYRO3 (0.41) EGFRBTK
SCHEMBL30499571 0.71 EGFR (0.40) EGFRNR3C2BTKALDH1A1CYP1A2
SCHEMBL30367257 0.70 TYRO3 (0.49) —
SCHEMBL21903789 0.69 BTK (0.52) EGFRBTK
SCHEMBL21903785 0.69 BTK (0.52) EGFRBTK

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 1 patent. 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
Send feedback