SCHEMBL31319561

SCHEMBL31319561

COc1ccnc(-c2c(Cl)ccc3c(S(=O)(=O)Cl)c[nH]c23)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.41
▸ CCR5 P51681 1/20 0.41
▸ CCR8 P51685 1/20 0.41
▸ PRKAB2 O43741 1/20 0.36
▸ PRKAG1 P54619 1/20 0.36
▸ PRKAA2 P54646 1/20 0.36
▸ PRKAA1 Q13131 1/20 0.36
▸ PRKAG3 Q9UGI9 1/20 0.36
▸ PRKAG2 Q9UGJ0 1/20 0.36
▸ PRKAB1 Q9Y478 1/20 0.36
▸ DYRK1A Q13627 3/20 0.36
▸ CCR9 P51686 1/20 0.36
▸ NFE2L2 Q16236 8/20 0.35
▸ GSK3B P49841 2/20 0.34
▸ CCNT1 O60563 2/20 0.34
▸ CDK9 P50750 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ DYRK3 O43781 1/20 0.34
▸ CCNB2 O95067 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34

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
SCHEMBL31319558 1.00 CCR1 (0.41) CCR1CCR5CCR8PRKAB2PRKAG1
SCHEMBL31319667 0.80 RXFP1 (0.36) CCR1CCR5CCR8NFE2L2KDM4E
SCHEMBL31438259 0.78 AAK1 (0.30) —
SCHEMBL31438286 0.78 DYRK1B (0.36) DYRK1AHPGDCDK2DYRK1B
SCHEMBL31438261 0.78 NPY5R (0.34) CCR9
SCHEMBL31438281 0.76 DCLK1 (0.33) CCR9GSK3BCCNT1CDK9CCNA2
SCHEMBL31438243 0.76 KAT8 (0.34) CCR9
SCHEMBL31438267 0.74 MET (0.33) ALDH1A1HTR6
SCHEMBL31438253 0.74 CCR9 (0.31) CCR9
SCHEMBL31438307 0.74 CSNK2A2 (0.31) —

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-2025038863-A1 INDOLE AND PYRROLOYPYRIDINE DERIVATIVES AS GPR17 MODULATORS BIOGEN MA INC. (US) 2025-02-20 — — WO disclosed
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