SCHEMBL9785263

SCHEMBL9785263

OC(Cn1cncn1)c1ccc(Oc2ccc(Cl)cc2)cc1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.41
HPGD P15428 1/20 0.41
KCNH2 Q12809 1/20 0.41
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.37
HSP90AA1 P07900 2/20 0.37
HTT P42858 3/20 0.36
LMNA P02545 2/20 0.36
ADRA2C P18825 1/20 0.36
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP19A1 P11511 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
CYP2C19 P33261 1/20 0.36
ADRA1A P35348 1/20 0.36
CYP51A1 Q16850 1/20 0.36

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
SCHEMBL9785297 0.91 CYP19A1 (0.43) POLBHPGDKMT2AKDM4EALDH1A1
SCHEMBL9785238 0.89 POLB (0.41) POLBHPGDKCNH2KMT2AKDM4E
SCHEMBL29622918 0.88 ADRA2C (0.45) POLBHPGDKMT2AKDM4EALDH1A1
SCHEMBL9785351 0.88 ADRA2C (0.45) POLBHPGDKMT2AKDM4EALDH1A1
SCHEMBL9785350 0.86 POLB (0.41) POLBHPGDKMT2AKDM4EALDH1A1
SCHEMBL9785251 0.86 POLB (0.41) POLBHPGDKMT2AKDM4EALDH1A1
SCHEMBL15756589 0.84 CYP19A1 (0.40) POLBHPGDKDM4EALDH1A1TSHR
SCHEMBL9785252 0.84 KMT2A (0.41) POLBHPGDKCNH2KMT2AKDM4E
SCHEMBL11182570 0.82 POLB (0.43) POLBHPGDKMT2AKDM4EALDH1A1
SCHEMBL18542636 0.81 POLB (0.41) POLBHPGDKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4992458-A Phytofungicides CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed
EP-0275955-B1 MICROBICIDAL COMPOSITION CIBA-GEIGY AG (CH) 1990-07-04 EP disclosed
EP-0275955-A1 Microbicidal composition CIBA-GEIGY AG (CH) 1988-07-27 EP disclosed