SCHEMBL31419331

SCHEMBL31419331

CCOC(=O)c1ccc2ncc(C(F)(F)F)cc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.55
ALDH1A1 P00352 5/20 0.53
KDM4E B2RXH2 3/20 0.53
HSD17B10 Q99714 2/20 0.53
HPGD P15428 2/20 0.53
NPC1 O15118 6/20 0.52
RAB9A P51151 5/20 0.52
MAPT P10636 3/20 0.48
LMNA P02545 1/20 0.48
PDGFRB P09619 1/20 0.48
PDGFRA P16234 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
POLB P06746 2/20 0.44
SMN1; SMN2 Q16637 4/20 0.44

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
SCHEMBL31133348 0.85 HTT (0.56) ALDH1A1KDM4EHPGDNPC1RAB9A
SCHEMBL18370699 0.85 HTT (0.56) ALDH1A1KDM4EHPGDNPC1RAB9A
SCHEMBL4430795 0.82 NPC1 (0.57) MAOBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL27600818 0.81 NPC1 (0.56) MAOBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL24368214 0.81 HTT (0.44) MAOBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL30523316 0.81 MAPT (0.48) MAOBKDM4EHPGDMAPTPOLB
SCHEMBL25527760 0.81 MAPT (0.48) MAOBKDM4EHPGDMAPTPOLB
SCHEMBL1285592 0.81 MAOB (0.76) MAOBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL1644595 0.81 MAOB (0.54) MAOBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL21355583 0.80 NPC1 (0.55) MAOBALDH1A1KDM4EHSD17B10NPC1

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
EP-4745134-A1 PROTEIN ARGINASE METHYLTRANSFERASE-5 INHIBITOR AND MEDICAL USE THEREOF Jiangsu Yahong Meditech Co., Ltd. (CN) 2026-05-20 EP disclosed
WO-2025016323-A1 PROTEIN ARGINASE METHYLTRANSFERASE-5 INHIBITOR AND MEDICAL USE THEREOF 江苏亚虹医药科技股份有限公司 2025-01-23 WO disclosed