SCHEMBL25850087

SCHEMBL25850087

NC(O)CCCCCNC=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 5/20 0.46
ADH1A P07327 5/20 0.46
ADH7 P40394 4/20 0.46
ADH1C P00326 4/20 0.46
ADH4 P08319 2/20 0.46
EPHX1 P07099 1/20 0.46
TRPV1 Q8NER1 1/20 0.33
TRPA1 O75762 1/20 0.33
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
ANPEP P15144 1/20 0.31
ERAP2 Q6P179 1/20 0.31
RRM1 P23921 1/20 0.30

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
SCHEMBL15241553 0.82 ADH1B (0.50) ADH1BADH1AADH7ADH1CADH4
SCHEMBL3609608 0.79 ADH1B (0.48) ADH1BADH1AADH7ADH1CADH4
SCHEMBL13624944 0.77 TSHR (0.42) TRPV1TRPA1
SCHEMBL11413206 0.76 ADH1B (0.50) ADH1BADH1AADH7ADH1CADH4
SCHEMBL12519632 0.76 ADH1B (0.50) ADH1BADH1AADH7ADH1CADH4
SCHEMBL10798330 0.75 TRPV1 (0.50) TRPV1TRPA1
SCHEMBL979732 0.75 ADH1B (0.72) ADH1BADH1AADH7ADH1CADH4
SCHEMBL27635113 0.75 ADH1B (0.72) ADH1BADH1AADH7ADH1CADH4
SCHEMBL11322360 0.75 ADH1B (0.72) ADH1BADH1AADH7ADH1CADH4
SCHEMBL8764004 0.75 ADH1B (0.72) ADH1BADH1AADH7ADH1CADH4

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-4212552-A1 ANTI-HER2 ANTIBODY-DRUG CONJUGATE Daiichi Sankyo Company, Limited (JP) 2023-07-19 EP disclosed