SCHEMBL19068630

SCHEMBL19068630

C/C=C\NCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.58
ADH1B P00325 2/20 0.58
ADH1C P00326 2/20 0.58
ADH1A P07327 2/20 0.58
ADH7 P40394 2/20 0.58
ADH4 P08319 1/20 0.58
TSHR P16473 3/20 0.43
ALDH1A1 P00352 1/20 0.43
THRB P10828 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
PPARA Q07869 2/20 0.37
GBA1 P04062 2/20 0.35
CASP2 P42575 1/20 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
SCHEMBL22157385 1.00 EPHX1 (0.58) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL22157384 1.00 EPHX1 (0.58) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL10350548 1.00 EPHX1 (0.58) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL11859016 1.00 EPHX1 (0.58) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL11859005 1.00 EPHX1 (0.58) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL16452855 1.00 EPHX1 (0.58) EPHX1ADH1BADH1CADH1AADH7
Ammonia Solution, Strong SCHEMBL10827255 0.98 EPHX1 (0.56) EPHX1ADH1BADH1CADH1AADH7
Ammonia Solution, Strong SCHEMBL10827263 0.98 EPHX1 (0.56) EPHX1ADH1BADH1CADH1AADH7
Ammonia Solution, Strong SCHEMBL10826393 0.98 EPHX1 (0.56) EPHX1ADH1BADH1CADH1AADH7
Ammonia Solution, Strong SCHEMBL7039907 0.98 EPHX1 (0.56) EPHX1ADH1BADH1CADH1AADH7

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
WO-2020190754-A1 MACROCYCLIC AZOLOPYRIDINE DERIVATIVES AS EED AND PRC2 MODULATORS Fulcrum Therapeutics, Inc. (US) 2020-09-24 WO disclosed
WO-2017201342-A1 POLYNUCLEOTIDES ENCODING JAGGED1 FOR THE TREATMENT OF ALAGILLE SYNDROME MODERNATX, INC. (US) 2017-11-23 WO disclosed
US-9695368-B2 Process and apparatus employing microchannel process technology VELOCYS, INC. (US) 2017-07-04 US disclosed