SCHEMBL20076432

SCHEMBL20076432

CCc1ccc(C2C(c3cccc(C)c3)C2(Cl)Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
ALDH1A1 P00352 2/20 0.40
RECQL P46063 1/20 0.40
TP53 P04637 3/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
HTR2C P28335 3/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
HTR2B P41595 1/20 0.36
SLC6A3 Q01959 1/20 0.36
POLB P06746 2/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL21022128 0.80 RXRA (0.33) ALDH1A1TP53KDM4EHTTCYP1A2
SCHEMBL20076857 0.76 IDH1 (0.33)
SCHEMBL20076689 0.74 NPSR1 (0.33) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21021656 0.71 CNR1 (0.34) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL21022153 0.71 KDM1A (0.34) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL20076455 0.70 SLC5A2 (0.34) HTR2CHTR2AHTR2B
SCHEMBL21021905 0.70 RXRA (0.32) TP53
SCHEMBL9608258 0.68 ACHE (0.39) ALDH1A1TP53LMNAMAPTHTR2C
SCHEMBL21021529 0.68 MEN1 (0.58) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21022303 0.67 KDM1A (0.33) MEN1KMT2AMAPT

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
WO-2018071327-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2018-04-19 WO disclosed