SCHEMBL9827345

SCHEMBL9827345

N#CCNC(=O)c1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSL P07711 8/20 0.61
EPHX2 P34913 1/20 0.51
CTSB P07858 1/20 0.51
CTSS P25774 1/20 0.51
CTSK P43235 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
LMNA P02545 2/20 0.50
NAMPT P43490 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
KMT2A Q03164 1/20 0.46

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
SCHEMBL8374746 0.83 NPC1 (0.51) NPC1RAB9ALMNAALDH1A1HPGD
SCHEMBL31474545 0.83 EPHX2 (0.50) CTSLEPHX2CTSBCTSSCTSK
SCHEMBL10451394 0.83 LMNA (0.58) CTSLCTSBCTSSCTSKNPC1
SCHEMBL9873510 0.81 CYP1A2 (0.56) CTSBNPC1RAB9ALMNANAMPT
SCHEMBL26261156 0.81 MEN1 (0.62) EPHX2NPC1RAB9ANAMPTALDH1A1
SCHEMBL17011384 0.81 KDM4E (0.58) CTSLEPHX2CTSBCTSSCTSK
SCHEMBL10764773 0.81 CTSL (0.59) CTSLCTSBCTSSCTSKNPC1
SCHEMBL2605517 0.81 CA12 (0.63) NPC1RAB9ALMNANAMPTALDH1A1
SCHEMBL2601677 0.81 CA12 (0.63) NPC1RAB9ALMNANAMPTALDH1A1
SCHEMBL2863808 0.81 GAA (0.61) CTSLCTSBCTSSCTSKLMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115724768-B Bisamide compound and preparation method and application thereof 广西思钺生物科技有限责任公司 2024-10-29 CN disclosed
CN-115724768-A Bisamide compound and preparation method and application thereof 广西思钺生物科技有限责任公司 2023-03-03 CN disclosed
EP-0442172-A1 Oxime derivatives and Herbicides containing the same as an active ingredient TEIJIN LIMITED (JP) 1991-08-21 EP disclosed
EP-0433451-A1 OXIME DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS AN ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1991-06-26 EP disclosed
WO-1990001874-A1 OXIME DERIVATIVES AND HERBICIDES CONTAINING THE SAME AS AN ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1990-03-08 WO disclosed