SCHEMBL21165773

SCHEMBL21165773

CC1=CC(C)(C)c2cc3c(cc21)Cc1cc2c(cc1-3)C(C)(C)C=C2C

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PGR P06401 12/20 0.41
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31

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
SCHEMBL2860612 0.92 PGR (0.44) PGRKDM4EMAPK1APOBEC3AAPOBEC3G
SCHEMBL22242680 0.82 PGR (0.41) PGR
SCHEMBL9453782 0.76 KDM4E (0.45) PGRKDM4EMAPK1APOBEC3AAPOBEC3G
SCHEMBL7528227 0.70 KDM4E (0.48) KDM4EMAPK1APOBEC3AAPOBEC3G
SCHEMBL2860741 0.67 PGR (0.32) PGR
SCHEMBL2870970 0.67 PGR (0.44) PGRKDM4E
SCHEMBL8145562 0.65 PDK2 (0.36) KDM4EMAPK1APOBEC3AAPOBEC3G
SCHEMBL2871846 0.64 PGR (0.36) PGR
SCHEMBL7258960 0.64 ALDH1A1 (0.39) KDM4EMAPK1APOBEC3AAPOBEC3G
SCHEMBL7258801 0.64 APOBEC3A (0.48) PGRKDM4EMAPK1APOBEC3AAPOBEC3G

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-1661921-B1 Synthetic lubricating oil and lubricating oil composition thereof MITSUI CHEMICALS INC (JP) 2019-07-17 EP disclosed