SCHEMBL7544981

SCHEMBL7544981

C=C(C#N)C(=O)NC(CCCCCC)OCC

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.36
GPR84 Q9NQS5 5/20 0.33
FFAR1 O14842 1/20 0.33
ZDHHC20 Q5W0Z9 2/20 0.32
ZDHHC2 Q9UIJ5 2/20 0.32
MAPT P10636 1/20 0.32
LCK P06239 1/20 0.32
PPARD Q03181 1/20 0.32
FAAH O00519 5/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
PLA2G2C Q5R387 1/20 0.31
MAPK1 P28482 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
SCHEMBL7542057 1.00 ALDH1A1 (0.38) ALDH1A1TSHRZDHHC7GPR84FFAR1
SCHEMBL7548739 1.00 ALDH1A1 (0.38) ALDH1A1TSHRZDHHC7GPR84FFAR1
SCHEMBL7541408 1.00 ALDH1A1 (0.38) ALDH1A1TSHRZDHHC7GPR84FFAR1
SCHEMBL7544155 0.99 ALDH1A1 (0.39) ALDH1A1TSHRZDHHC7GPR84FFAR1
SCHEMBL7546479 0.94 ALDH1A1 (0.40) ALDH1A1TSHRPLA2G2C
SCHEMBL7547002 0.90 ZDHHC7 (0.35) ALDH1A1TSHRZDHHC7GPR84FFAR1
SCHEMBL7550556 0.90 ZDHHC7 (0.35) ALDH1A1TSHRZDHHC7GPR84FFAR1
SCHEMBL7550806 0.90 ZDHHC7 (0.35) ALDH1A1TSHRZDHHC7GPR84FFAR1
SCHEMBL7544971 0.90 ZDHHC7 (0.35) ALDH1A1TSHRZDHHC7GPR84FFAR1
SCHEMBL7542605 0.90 ZDHHC7 (0.35) ALDH1A1TSHRZDHHC7GPR84FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH S.N. BIOTECH, INC. 2002-05-30 US claimed
US-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH S.N. BIOTECH, INC. 2002-05-30 US disclosed
US-5767152-A USING A CYANOCARBOXYLIC ACID S.N. BIOTECH, INC. 1998-06-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020065314-A1 COMPOSITIONS AND METHOD FOR STIMULATING HAIR GROWTH AREG, NGF, HDGF ALDH1A1 3677/4885TSHR 148/4885ZDHHC7 719/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.