SCHEMBL30910885

SCHEMBL30910885

OC(c1ccc(Cl)cc1)c1ccc(F)cn1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.45
APLNR P35414 1/20 0.42
S1PR3 Q99500 8/20 0.40
S1PR1 P21453 2/20 0.40
BRD4 O60885 1/20 0.37
DRD2 P14416 1/20 0.37
S1PR4 O95977 3/20 0.35
S1PR2 O95136 2/20 0.35
CYP19A1 P11511 1/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL21910195 1.00 FFAR2 (0.45) FFAR2APLNRS1PR3S1PR1BRD4
SCHEMBL21831494 0.90 LMNA (0.44) S1PR3S1PR1BRD4S1PR4S1PR2
SCHEMBL21831287 0.89 APLNR (0.46) FFAR2APLNRDRD2KMT2A
SCHEMBL30910915 0.89 APLNR (0.46) FFAR2APLNRDRD2KMT2A
SCHEMBL21831379 0.85 BRD4 (0.46) S1PR3S1PR1BRD4S1PR4S1PR2
SCHEMBL30910928 0.85 BRD4 (0.46) S1PR3S1PR1BRD4S1PR4S1PR2
SCHEMBL133374 0.82 CYP11B1 (0.44) APLNRHPGDLMNAKMT2ASMN1; SMN2
SCHEMBL14033601 0.79 S1PR3 (0.45) S1PR3S1PR1S1PR4S1PR2RAB9A
SCHEMBL21831035 0.79 S1PR3 (0.44) S1PR3S1PR1BRD4S1PR4S1PR2
SCHEMBL21911304 0.79 FFAR2 (0.48) FFAR2APLNRS1PR3S1PR1DRD2

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-112654621-B Substituted naphthyridinone compounds useful as T cell activators 百时美施贵宝公司 2024-05-14 CN disclosed