SCHEMBL24710035

SCHEMBL24710035

CCCC(CC)CCC(CC)CCN

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP3A4 P08684 2/20 0.38
CA2 P00918 3/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
TSHR P16473 1/20 0.32
OPRM1 P35372 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
SCHEMBL1547342 0.97
SCHEMBL19588980 0.97
SCHEMBL18321799 0.91 ALDH1A1 (0.43) ALDH1A1TDP1CYP3A4CA2TSHR
SCHEMBL18573986 0.88 ALDH1A1 (0.42) ALDH1A1TDP1CYP3A4
SCHEMBL9796321 0.88
SCHEMBL16202951 0.85 ALDH1A1 (0.38) ALDH1A1TDP1CYP3A4CA2CA12
SCHEMBL4854735 0.85 ALDH1A1 (0.38) ALDH1A1TDP1CYP3A4CA2CA12
SCHEMBL27434652 0.83 ALDH1A1 (0.33) ALDH1A1TDP1CYP3A4
Hydrochloric Acid SCHEMBL26976882 0.82 DNM1 (0.36) ALDH1A1TDP1CYP3A4CA2CA12
SCHEMBL44444 0.82

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-20220397997-A1 DISPLAY APPARATUS SAMSUNG DISPLAY CO., LTD (KR) 2022-12-15 US disclosed