SCHEMBL7737753

SCHEMBL7737753

CCCCCC/C=C(\C#N)C(=O)OCC(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.40
THRB P10828 1/20 0.40
EP300 Q09472 1/20 0.40
CYP2C9 P11712 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 2/20 0.38
FAAH O00519 2/20 0.37
DGKA P23743 1/20 0.36
PPARG P37231 7/20 0.35
PPARA Q07869 2/20 0.35

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
SCHEMBL7544404 1.00 MAPT (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7543402 1.00 MAPT (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL21141866 1.00 MAPT (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7743885 1.00 MAPT (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7743752 0.98 MAPT (0.43) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7542229 0.98 MAPT (0.43) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7745781 0.94 ALDH1A1 (0.43) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7547010 0.94 ALDH1A1 (0.43) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7544282 0.88 ALDH1A1 (0.45) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7737775 0.88 ALDH1A1 (0.45) MAPTALDH1A1MEN1KMT2AKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0824316-A4 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH NIELSEN THOR B (US) 2001-01-17 EP claimed
US-5767152-A USING A CYANOCARBOXYLIC ACID S.N. BIOTECH, INC. 1998-06-16 US claimed
EP-0824316-A1 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH Nielsen, Thor, B. (US) 1998-02-25 EP claimed
WO-1996034526-A1 COMPOSITIONS AND METHODS FOR STIMULATING HAIR GROWTH NIELSEN THOR B (US) 1996-11-07 WO claimed