SCHEMBL31580933

SCHEMBL31580933

NCCNC(c1ccc(Br)cn1)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 1/20 0.31
S1PR3 Q99500 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
SCHEMBL31580941 0.85 ALDH1A1 (0.32) S1PR4S1PR3
SCHEMBL31580571 0.84 TAAR1 (0.33) S1PR4S1PR3
SCHEMBL31580589 0.83 RAB9A (0.32)
SCHEMBL26650249 0.82 GBA1 (0.37) S1PR4S1PR3
SCHEMBL26650250 0.82 GBA1 (0.37) S1PR4S1PR3
Hydrochloric Acid SCHEMBL31580455 0.81 GBA1 (0.32)
SCHEMBL15240872 0.77 S1PR4 (0.37) S1PR4S1PR3
SCHEMBL31580278 0.77 KDM4E (0.32)
SCHEMBL15240312 0.76 S1PR4 (0.35) S1PR4S1PR3
SCHEMBL31391923 0.76 S1PR4 (0.35) S1PR4S1PR3

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-2025104411-A1 THERAPEUTIC COMPOUNDS C4X DISCOVERY LIMITED (GB) 2025-05-22 WO disclosed