SCHEMBL7288102

SCHEMBL7288102

C=CCCCCCC(C)[O]

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
MAPT P10636 5/20 0.46
ABCC4 O15439 1/20 0.46
ALDH1A1 P00352 5/20 0.46
USP2 O75604 4/20 0.46
CYP3A4 P08684 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 2/20 0.45
RECQL P46063 1/20 0.40
LPAR2 Q9HBW0 1/20 0.36
LPAR3 Q9UBY5 1/20 0.36
CYP2C9 P11712 1/20 0.35
TRPA1 O75762 1/20 0.34

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
SCHEMBL7295709 1.00 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL10400808 0.90
SCHEMBL8425055 0.81 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL19639475 0.81 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL22493532 0.81 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL8834848 0.81 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL22493533 0.81 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL22493527 0.81 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL14743385 0.81 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2
SCHEMBL5575846 0.81 TSHR (0.48) TSHRMAPTABCC4ALDH1A1USP2

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-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed