SCHEMBL7670514

SCHEMBL7670514

Cc1cccc2c1SCCS2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CYP2A6 P11509 2/20 0.35
CYP1A2 P05177 1/20 0.35
ALDH1A1 P00352 4/20 0.33
TSHR P16473 2/20 0.33
LMNA P02545 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
RAB9A P51151 1/20 0.33
ACHE P22303 1/20 0.33
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
GAA P10253 1/20 0.32
MCL1 Q07820 1/20 0.32

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
SCHEMBL8370317 0.73 HPGD (0.36) MEN1KMT2ACA1CA2CA7
SCHEMBL7820452 0.73
SCHEMBL1402608 0.72 VHL (0.31) MEN1KMT2AALDH1A1GAARYR2
SCHEMBL10422363 0.72 VHL (0.31) MEN1KMT2AALDH1A1GAARYR2
SCHEMBL10423038 0.72 VHL (0.31) MEN1KMT2AALDH1A1GAARYR2
SCHEMBL8290712 0.71 MEN1 (0.38) MEN1KMT2ACA1CA2CA7
SCHEMBL14451090 0.71 HPGD (0.36) MEN1KMT2ACA1CA2CA7
SCHEMBL8051363 0.70
SCHEMBL3419815 0.70 MEN1 (0.47) MEN1KMT2ACA1CA2CA7
SCHEMBL14188456 0.70 ALDH1A1 (0.36) KMT2AALDH1A1CYP3A4TRPA1

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
US-6352959-B1 HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-03-05 US disclosed