SCHEMBL9575396

SCHEMBL9575396

C=C(F)C(=O)Oc1ccc(C)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
ALDH1A1 P00352 1/20 0.44
ELANE P08246 1/20 0.42
GAA P10253 1/20 0.42
BCHE P06276 1/20 0.41
KMT2A Q03164 4/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PTK2B Q14289 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
ATM Q13315 1/20 0.39
PRSS1 P07477 1/20 0.39
ACR P10323 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL15834836 0.83 KIF11 (0.43) LMNAELANEGAAKMT2ACYP1A2
SCHEMBL7064531 0.83 LMNA (0.70) LMNAALDH1A1GAAKMT2ACYP1A2
SCHEMBL28239966 0.82 LMNA (0.57) LMNAALDH1A1ELANEGAAKMT2A
SCHEMBL146180 0.82 LMNA (0.63) LMNAALDH1A1ELANEGAAKMT2A
SCHEMBL9575401 0.82 KMT2A (0.41) ALDH1A1ELANEKMT2ACYP1A2ATM
SCHEMBL29303770 0.80 LMNA (0.55) LMNAALDH1A1ELANEGAAKMT2A
SCHEMBL9575349 0.80 ELANE (0.39) LMNAELANEKMT2AATM
SCHEMBL9575199 0.80 MEN1 (0.41) LMNAALDH1A1ELANEKMT2AMAPT
SCHEMBL9575390 0.80 LDHA (0.41) LMNAALDH1A1ELANEKMT2ARXFP1
SCHEMBL9575359 0.80 ELANE (0.42) ELANEBCHEKMT2ACYP1A2CYP2C19

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
US-5266668-A Substituted phenyl α-fluoroacrylates HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-30 US disclosed