SCHEMBL8374759

SCHEMBL8374759

C[CH]NC(CCCCCCC)CCCCCCCCC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.47
ADH1C P00326 1/20 0.47
ADH1A P07327 1/20 0.47
ADH4 P08319 1/20 0.47
ADH7 P40394 1/20 0.47
LMNA P02545 1/20 0.39
DNM1 Q05193 6/20 0.39
EPHX1 P07099 2/20 0.39
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.38
OPRM1 P35372 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GPR84 Q9NQS5 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
SCHEMBL8374807 1.00 ADH1B (0.47) ADH1BADH1CADH1AADH4ADH7
SCHEMBL2964896 0.81 ALDH1A1 (0.38) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1364036 0.79 TAS1R3 (0.34)
SCHEMBL20835080 0.79 ADH1B (0.67) ADH1BADH1CADH1AADH4ADH7
SCHEMBL22157374 0.79 ADH1B (0.41) ADH1BADH1CADH1AADH4ADH7
SCHEMBL11111750 0.79 ADH1B (0.67) ADH1BADH1CADH1AADH4ADH7
SCHEMBL18558683 0.79 ADH1B (0.67) ADH1BADH1CADH1AADH4ADH7
SCHEMBL22157362 0.79 ADH1B (0.41) ADH1BADH1CADH1AADH4ADH7
SCHEMBL22157372 0.79 ADH1B (0.41) ADH1BADH1CADH1AADH4ADH7
SCHEMBL22157364 0.79 ADH1B (0.41) ADH1BADH1CADH1AADH4ADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5986042-A Cross-linked polymer MITSUI CHEMICALS, INC. (JP) 1999-11-16 US disclosed
EP-0856539-A1 Cross-linked polymer Mitsui Chemicals, Inc. (JP) 1998-08-05 EP disclosed