SCHEMBL16706307

SCHEMBL16706307

CCNc1cccc(OBO)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 5/20 0.41
MTNR1A P48039 3/20 0.41
F10 P00742 1/20 0.41
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
MAPT P10636 3/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
THRB P10828 2/20 0.35
HTT P42858 2/20 0.35
HSD17B10 Q99714 1/20 0.35
THRA P10827 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 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
SCHEMBL38660132 0.78 MTNR1B (0.57) MTNR1BMTNR1AALDH1A1HPGDMAPT
SCHEMBL17279024 0.78 ADRA2A (0.43) ALDH1A1MAPTKMT2AMEN1CYP1A2
SCHEMBL42399 0.78 MTNR1B (0.57) MTNR1BMTNR1AALDH1A1HPGDMAPT
SCHEMBL28471149 0.77 MTNR1B (0.55) MTNR1BMTNR1AALDH1A1HPGDMAPT
SCHEMBL146848 0.77 TP53 (0.53) ALDH1A1HPGDMAPTKMT2ASMN1; SMN2
SCHEMBL8292660 0.75 MITF (0.51) F10ALDH1A1HPGDMAPTKMT2A
SCHEMBL8292685 0.75 ALDH1A1 (0.48) MTNR1BMTNR1AALDH1A1KMT2ATHRB
SCHEMBL7116339 0.75 MTNR1A (0.55) MTNR1BMTNR1AALDH1A1MAPTKMT2A
SCHEMBL27683582 0.75 MEN1 (0.59) MTNR1BMTNR1AALDH1A1HPGDMAPT
SCHEMBL3363357 0.74 MAPT (0.50) ALDH1A1HPGDMAPTKMT2AMEN1

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-20150129226-A1 Thickening of Fluids SCHLUMBERGER TECHNOLOGY CORPORATION 2015-05-14 US disclosed