SCHEMBL8086406

SCHEMBL8086406

CCC(C)COc1ccc(C(=O)O)cc1OCC(C)CC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
MAPT P10636 1/20 0.56
POLB P06746 1/20 0.52
CASP6 P55212 1/20 0.52
RAB9A P51151 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA7 P43166 1/20 0.49
TPMT P51580 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
LMNA P02545 2/20 0.47
MAPK1 P28482 1/20 0.45
HTT P42858 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
SCHEMBL8086405 1.00 TSHR (0.56) TSHRMAPTPOLBCASP6RAB9A
Hydrochloric Acid SCHEMBL8084683 0.98 TSHR (0.55) TSHRMAPTPOLBCASP6RAB9A
Hydrochloric Acid SCHEMBL8084681 0.98 TSHR (0.55) TSHRMAPTPOLBCASP6RAB9A
SCHEMBL8973461 0.87 RAB9A (0.60) TSHRMAPTRAB9AKDM4EALDH1A1
SCHEMBL9151344 0.87 RAB9A (0.60) TSHRMAPTRAB9AKDM4EALDH1A1
SCHEMBL8084680 0.86 MAPT (0.44) TSHRMAPTPOLBCASP6RAB9A
SCHEMBL10905811 0.83 EGFR (0.53) TSHRMAPTPOLBCASP6KDM4E
SCHEMBL7696613 0.83 ALDH1A1 (0.64) MAPTALDH1A1
SCHEMBL7696616 0.83 ALDH1A1 (0.64) MAPTALDH1A1
SCHEMBL8080653 0.83 MAPT (0.50) TSHRMAPTPOLBCA12CA1

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
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed