SCHEMBL29914409

SCHEMBL29914409

CS(=O)(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.53
▸ RORC P51449 1/20 0.47
▸ GPR119 Q8TDV5 3/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ LSS P48449 1/20 0.44
▸ CYP3A4 P08684 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ NPY5R Q15761 1/20 0.43
▸ HSD11B1 P28845 1/20 0.43
▸ WDR91 A4D1P6 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ PSEN1 P49768 2/20 0.40
▸ PSEN2 P49810 2/20 0.40
▸ APH1B Q8WW43 2/20 0.40
▸ NCSTN Q92542 2/20 0.40
▸ APH1A Q96BI3 2/20 0.40
▸ PSENEN Q9NZ42 2/20 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
SCHEMBL24681271 1.00 NOTUM (0.53) NOTUMRORCGPR119MEN1KMT2A
SCHEMBL27926423 0.82 RORC (0.46) NOTUMRORCGPR119
SCHEMBL27337897 0.82 RORC (0.44) NOTUMRORCGPR119MEN1KMT2A
SCHEMBL31319987 0.80 NOTUM (0.43) NOTUMRORCNPY5R
SCHEMBL23507300 0.78 NOTUM (0.56) NOTUMMEN1KMT2ALMNAHDAC1
SCHEMBL29157649 0.76 LSS (0.55) NOTUMGPR119MEN1KMT2ALSS
SCHEMBL29157650 0.76 LSS (0.55) NOTUMGPR119MEN1KMT2ALSS
SCHEMBL29157657 0.76 LSS (0.55) NOTUMGPR119MEN1KMT2ALSS
SCHEMBL29914435 0.75 ACVR1 (0.41) RORCGPR119PTGS2
SCHEMBL29914621 0.75 ACVR1 (0.41) RORCGPR119PTGS2

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
WO-2022226667-A1 SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — WO disclosed
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