SCHEMBL30175356

SCHEMBL30175356

Cc1cnn(-c2ccc([C@H](C)N[S+]([O-])C(C)(C)C)cn2)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.36
RET P07949 8/20 0.32
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CYP1A2 P05177 2/20 0.31
P2RX3 P56373 1/20 0.31
HPGD P15428 2/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL23957695 1.00 EGLN1 (0.36) EGLN1RETALDH1A1NPC1RAB9A
SCHEMBL23929889 0.87 RET (0.38) EGLN1RET
SCHEMBL18821888 0.87 RET (0.38) EGLN1RET
SCHEMBL28938110 0.87 EGLN1 (0.37) EGLN1P2RX3
SCHEMBL23957787 0.87 RET (0.38) EGLN1RET
SCHEMBL17966632 0.87 RET (0.38) EGLN1RET
SCHEMBL18806642 0.87 RET (0.38) EGLN1RET
SCHEMBL23957802 0.87 EGLN1 (0.37) EGLN1P2RX3
SCHEMBL17966631 0.87 RET (0.38) EGLN1RET
SCHEMBL28722963 0.87 RET (0.38) EGLN1RET

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-115605477-B Pyrazolo [1,5-a ] pyridine derivative, preparation method, composition and application thereof 深圳众格生物科技有限公司 2024-07-05 CN disclosed
CN-115605477-A Pyrazolo [1,5-a ] pyridine derivative and preparation method, composition and application thereof 深圳众格生物科技有限公司(CN) 2023-01-13 CN disclosed