SCHEMBL9850187

SCHEMBL9850187

CCCCCCCCC(=O)Oc1ccccc1-c1ccc(C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
KDM4E B2RXH2 1/20 0.56
RECQL P46063 1/20 0.56
POLM Q9NP87 2/20 0.54
POLK Q9UBT6 2/20 0.54
POLL Q9UGP5 2/20 0.54
POLH Q9Y253 2/20 0.54
RARB P10826 8/20 0.49
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
ALDH1A1 P00352 1/20 0.48
RARA P10276 1/20 0.48
MAPT P10636 1/20 0.48
MTOR P42345 1/20 0.48
PTPN11 Q06124 2/20 0.47
SOAT1 P35610 2/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46

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
SCHEMBL6702965 1.00 MEN1 (0.56) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL5167656 0.91 POLM (0.60) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL31094341 0.91 POLM (0.60) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL34470595 0.89 KDM4E (0.60) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL27544260 0.89 KDM4E (0.60) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL6702957 0.86 KDM4E (0.51) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL9850178 0.86 KDM4E (0.51) MEN1KMT2AKDM4ERECQLPOLM
Phosphoric Acid SCHEMBL28673788 0.86 POLM (0.55) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL16236486 0.85 KDM4E (0.66) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL14315096 0.85 POLM (0.66) MEN1KMT2AKDM4ERECQLPOLM

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
EP-0418604-A1 Liquid crystal compound Showa Shell Sekiyu Kabushiki Kaisha (JP) 1991-03-27 EP disclosed