SCHEMBL16856533

SCHEMBL16856533

OC1CCCCC[C@@H](O)CC(O)CCCCC(O)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.64
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
ALDH1A1 P00352 4/20 0.32
HSD17B10 Q99714 1/20 0.32
EPHX1 P07099 5/20 0.30
CYP3A4 P08684 2/20 0.30
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
KDM4E B2RXH2 1/20 0.30
EPHX2 P34913 1/20 0.30
MGLL Q99685 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
SCHEMBL13889159 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL15484232 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL15484298 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL2154470 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL15337087 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL10795387 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL13888941 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL13375682 0.96 TSHR (0.60) TSHRLMNACYP2C9CES2CES1
SCHEMBL3089221 0.96
SCHEMBL3089224 0.96

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-9531004-B2 Multifunctional hybrid coatings for electrodes made by atomic layer deposition techniques GM Global Technology Operations LLC (US) 2016-12-27 US disclosed
US-20150180023-A1 MULTIFUNCTIONAL HYBRID COATINGS FOR ELECTRODES MADE BY ATOMIC LAYER DEPOSITION TECHNIQUES GM Global Technology Operations LLC (US) 2015-06-25 US disclosed