SCHEMBL9535882

SCHEMBL9535882

CCOC(=O)OC1CCCCN1C(=O)Cc1cccc(C)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
KMT2A Q03164 2/20 0.39
CCR3 P51677 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRK1 P41145 1/20 0.39
KDM4E B2RXH2 4/20 0.39
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
ALDH1A1 P00352 7/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
GAA P10253 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
SCHEMBL9727263 0.84 ALDH1A1 (0.48) HPGDKMT2AKDM4EAPOBEC3AAPOBEC3G
SCHEMBL9538257 0.84 KMT2A (0.49) HPGDKMT2AOPRM1OPRK1KDM4E
SCHEMBL9536562 0.83 OPRK1 (0.44) HPGDKMT2AOPRM1OPRK1KDM4E
SCHEMBL9538264 0.81 PLA2G1B (0.38) HPGDKMT2AOPRM1OPRK1ALDH1A1
SCHEMBL9538321 0.81 SIGMAR1 (0.49) HPGDKMT2AOPRM1OPRK1ALDH1A1
SCHEMBL9536076 0.81 SMN1; SMN2 (0.38) KMT2AOPRM1OPRK1SMN1; SMN2MEN1
SCHEMBL9534208 0.79 KMT2A (0.60) KMT2AKDM4EALDH1A1SMN1; SMN2TDP1
SCHEMBL9536709 0.79 OPRK1 (0.36) HPGDKMT2AOPRM1OPRK1KDM4E
SCHEMBL9535404 0.78 MEN1 (0.38) KMT2AOPRM1OPRK1KDM4EALDH1A1
SCHEMBL9539327 0.77 OPRK1 (0.42) HPGDKMT2AOPRM1OPRK1SMN1; SMN2

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
EP-0355599-B1 3-ARYL-PYRROLIDINE-2,4-DIONES BAYER AG (DE) 1993-05-19 EP disclosed
EP-0355599-A1 3-Aryl-pyrrolidine-2,4-diones BAYER AG (DE) 1990-02-28 EP disclosed