SCHEMBL9253992

SCHEMBL9253992

CCC(Cl)C(F)=Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NR1I2 O75469 1/20 0.38
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
AKR1C3 P42330 1/20 0.37
LMNA P02545 2/20 0.37
KDM1A O60341 1/20 0.37
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
FBP1 P09467 2/20 0.34
MAPT P10636 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL9253991 1.00 MEN1 (0.40) MEN1KMT2ANR1I2ALDH1A1TSHR
SCHEMBL9254584 0.84 TRPA1 (0.40) ALDH1A1AKR1C3FBP1CYP2C9
SCHEMBL4134417 0.76 MEN1 (0.46) MEN1KMT2ANR1I2ALDH1A1TSHR
SCHEMBL9967695 0.74 ALDH1A1 (0.43) MEN1KMT2AALDH1A1TSHRAKR1C3
SCHEMBL2572851 0.71 ALDH1A1 (0.40) ALDH1A1TSHRAKR1C3KDM1AFBP1
SCHEMBL14416291 0.70 KDM1A (0.46) MEN1KMT2ANR1I2ALDH1A1TSHR
SCHEMBL256695 0.70 KDM1A (0.46) MEN1KMT2ANR1I2ALDH1A1TSHR
SCHEMBL9310823 0.70 KDM1A (0.46) MEN1KMT2ANR1I2ALDH1A1TSHR
SCHEMBL18321220 0.67 ALDH1A1 (0.45) MEN1KMT2AALDH1A1TSHRAKR1C3
SCHEMBL11073623 0.66 FBP1 (0.48) MEN1KMT2AALDH1A1TSHRAKR1C3

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
US-5462961-A Insecticides, acaricides, fungicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-10-31 US disclosed
EP-0390498-B1 A heterocyclic compound, production of same and use SUMITOMO CHEMICAL CO (JP) 1994-07-27 EP disclosed