SCHEMBL29559529

SCHEMBL29559529

CC(C)c1ccc(O)cc1NC(=O)CCl

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.58
ALDH1A1 P00352 9/20 0.46
KDM4E B2RXH2 2/20 0.46
NPC1 O15118 1/20 0.46
MITF O75030 1/20 0.46
THRB P10828 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
HTT P42858 1/20 0.46
LMNA P02545 2/20 0.43
PKM P14618 2/20 0.42
MAPT P10636 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL22897728 1.00 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL22897575 0.84 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL29559776 0.84 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL16029949 0.84 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL31520538 0.84 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL17536226 0.84 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL22897541 0.82 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL22897704 0.82 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL29559964 0.82 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1KDM4ENPC1MITF
SCHEMBL22897700 0.81 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1KDM4ENPC1MITF

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-114072000-A Molecules having certain pesticidal effects and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2022-02-18 CN disclosed