SCHEMBL14520640

SCHEMBL14520640

[O-][S+](c1ccccc1)n1ccc2c(Cl)ccnc21

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ENPP3 O14638 2/20 0.41
▸ ENPP1 P22413 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL20849808 0.82 MGAM (0.32) —
SCHEMBL21170650 0.79 PDE4A (0.38) MEN1ALDH1A1KMT2A
SCHEMBL21307499 0.75 CCNB2 (0.35) —
SCHEMBL25802928 0.73 ENPP3 (0.32) ENPP3ENPP1
SCHEMBL18380996 0.73 ENPP3 (0.32) ENPP3ENPP1
SCHEMBL24200698 0.73 ALDH1A1 (0.36) KDM4EALDH1A1TDP1
SCHEMBL1150451 0.70 ENPP3 (0.46) ENPP3ENPP1KDM4EMEN1ALDH1A1
SCHEMBL24491130 0.69 MAP3K8 (0.31) —
SCHEMBL21470789 0.69 MGAM (0.31) —
SCHEMBL19730198 0.68 FGFR1 (0.49) ENPP3ENPP1MEN1ALDH1A1KMT2A

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-2023076849-A1 INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR ORIC PHARMACEUTICALS, INC. (US) 2023-05-04 — — WO disclosed
WO-2007067537-A1 PYRROLOPYRIDINE KINASE INHIBITING COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2007-06-14 — — WO disclosed
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