SCHEMBL11259697

SCHEMBL11259697

O=C(O)[C@H]1CCCC[C@H]1c1ccccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
KEAP1 Q14145 2/20 0.43
PIN1 Q13526 1/20 0.43
LMNA P02545 2/20 0.42
RAB9A P51151 2/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
PPIA P62937 1/20 0.42
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
TAAR1 Q96RJ0 2/20 0.41
CYP2C19 P33261 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 2/20 0.40
HSD17B10 Q99714 2/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL3691542 0.83 CYP2C9 (0.44) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL2014692 0.81 KEAP1 (0.44) MEN1KMT2AKEAP1LMNARAB9A
SCHEMBL6852217 0.81 KMT2A (0.81) MEN1KMT2APIN1LMNARAB9A
SCHEMBL31053816 0.80 FFAR1 (0.49) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL18338986 0.80 FFAR1 (0.49) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL838634 0.78 KCNQ3 (0.56) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL12354198 0.78 KCNQ3 (0.56) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL22492062 0.78 KCNQ3 (0.56) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL22492058 0.78 KCNQ3 (0.56) MEN1KMT2ALMNARAB9AMAPT
SCHEMBL1752183 0.77 SLC6A2 (0.56) MEN1KMT2ALMNARAB9AMAPT

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-4336398-A Process for the preparation of basic esters of substituted hydroxycyclohexanecarboxylic acids LABORATORIO GUIDOTTI & C. S.P.A. (IT) 1982-06-22 US disclosed