SCHEMBL11273243

SCHEMBL11273243

CCOC(=O)C1c2cc3ccccc3cc2C(C(=O)OCC)N1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 3/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
CCR8 P51685 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
OPRM1 P35372 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL11275259 0.71 KDM4E (0.42) KMT2AKDM4EPKMALDH1A1MEN1
SCHEMBL11273241 0.69 GRK6 (0.49) KMT2AKDM4ERAB9AALDH1A1MEN1
SCHEMBL8106785 0.69 CHRM1 (0.47)
SCHEMBL22194510 0.69 KDM4E (0.45) KMT2AKDM4EAPOBEC3AAPOBEC3GPKM
Hydrochloric Acid SCHEMBL30028644 0.67 CYP3A4 (0.39) KMT2AKDM4EALDH1A1MEN1MAPT
SCHEMBL10746773 0.67 ALDH1A1 (0.40) KMT2AKDM4EAPOBEC3AAPOBEC3GPKM
SCHEMBL4139032 0.67 SLC6A4 (0.48)
SCHEMBL4139034 0.67 SLC6A4 (0.48)
SCHEMBL12490981 0.66 NOD2 (0.55) KMT2AKDM4EALDH1A1MEN1OPRM1
SCHEMBL5422670 0.65 KMT2A (0.64) KMT2AKDM4EPKMALDH1A1MEN1

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-4351842-A N-Cyclopropylisoindolines GLAXO LABORATORIES LIMITED (GB) 1982-09-28 US disclosed