SCHEMBL15940348

SCHEMBL15940348

c1ccc(-c2ccc(Cc3ccc(Oc4ccc(Cc5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.58
LTA4H P09960 5/20 0.54
ACACB O00763 1/20 0.53
ACACA Q13085 1/20 0.53
IDO1 P14902 2/20 0.48
AGXT P21549 2/20 0.48
TAAR1 Q96RJ0 1/20 0.48
TSHR P16473 1/20 0.48
CALM1 P0DP23 1/20 0.48
MMP12 P39900 1/20 0.46
MMP13 P45452 1/20 0.46
FFAR1 O14842 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
GSTP1 P09211 2/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2B Q13224 1/20 0.45

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
SCHEMBL10053900 0.98 SRD5A2 (0.61) SRD5A2LTA4HACACBACACAIDO1
SCHEMBL19360420 0.90 LTA4H (0.50) SRD5A2LTA4HACACBACACAGRIN1
SCHEMBL19360431 0.90 LTA4H (0.71) SRD5A2LTA4HACACBACACAGRIN1
SCHEMBL246373 0.88 LTA4H (0.67) SRD5A2LTA4HACACBACACATSHR
SCHEMBL7178244 0.88 LTA4H (0.67) SRD5A2LTA4HACACBACACATSHR
SCHEMBL23098203 0.88 SRD5A2 (0.70) SRD5A2LTA4HTSHRCALM1FFAR1
SCHEMBL9906839 0.88 SRD5A2 (0.70) SRD5A2LTA4HTSHRCALM1FFAR1
SCHEMBL11027481 0.86 LTA4H (0.61) SRD5A2LTA4HACACBACACACALM1
SCHEMBL26373185 0.86 SRD5A2 (0.46) SRD5A2LTA4HACACBACACAIDO1
SCHEMBL10269397 0.86 SRD5A2 (0.68) SRD5A2LTA4HTSHRCALM1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8815000-B1 Solid inks comprising liquid crystalline materials XEROX CORPORATION (US) 2014-08-26 US claimed
US-20140225956-A1 SOLID INKS COMPRISING LIQUID CRYSTALLINE MATERIALS XEROX CORPORATION (US) 2014-08-14 US claimed
US-8815000-B1 Solid inks comprising liquid crystalline materials XEROX CORPORATION (US) 2014-08-26 US disclosed
US-20140225956-A1 SOLID INKS COMPRISING LIQUID CRYSTALLINE MATERIALS XEROX CORPORATION (US) 2014-08-14 US disclosed