SCHEMBL31049532

SCHEMBL31049532

Fc1cn(CCOCCn2cc(Br)cn2)c2c(F)cccc12

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.36
▸ PLAU P00749 1/20 0.35
▸ ELANE P08246 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ ICMT O60725 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ TSHR P16473 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ KMT2A Q03164 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ CNR1 P21554 1/20 0.30
▸ CNR2 P34972 1/20 0.30

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
SCHEMBL31049393 0.86 ICMT (0.41) ALDH1A1PLAUELANEGAAHTT
SCHEMBL31049268 0.76 ALDH1A1 (0.36) ALDH1A1PLAUELANEGAAHTT
SCHEMBL31049571 0.76 ALDH1A1 (0.36) ALDH1A1PLAUELANEGAAHTT
SCHEMBL31049356 0.76 CNR2 (0.47) ALDH1A1GAAHTTHPGDKMT2A
SCHEMBL31049311 0.75 CNR2 (0.37) ALDH1A1HPGDPOLBLMNAMAPK1
SCHEMBL31049305 0.72 PLAU (0.34) ALDH1A1PLAUELANEGAAHTT
SCHEMBL31049379 0.70 ALDH1A1 (0.39) ALDH1A1HPGDTSHRLMNAMAPK1
SCHEMBL27032359 0.69 HPGD (0.38) ALDH1A1HPGDPOLBTSHRLMNA
SCHEMBL27032021 0.68 SMN1; SMN2 (0.45) ALDH1A1RAB9AHPGDTSHRLMNA
SCHEMBL27077566 0.68 ALDH1A1 (0.37) ALDH1A1HTTRAB9AHPGDTSHR

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-118359627-A MTA synergistic PRMT5 inhibitor compounds having a tetracyclic fused ring structure 烨辉医药科技(上海)有限公司 2024-07-19 — — CN disclosed
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