SCHEMBL8081848

SCHEMBL8081848

CCCC(C)Oc1ccc(C(=O)O)cc1OC(C)CCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.49
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
PDE4A P27815 3/20 0.48
PDE4B Q07343 3/20 0.48
PDE4C Q08493 3/20 0.48
PDE4D Q08499 3/20 0.48
ALDH1A1 P00352 2/20 0.46
RAB9A P51151 2/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
POLB P06746 1/20 0.43
CASP6 P55212 1/20 0.43

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
SCHEMBL8072162 0.87 CA12 (0.51) TSHRCA12CA1CA2CA4
SCHEMBL1748872 0.87 RAB9A (0.56) TSHRCA12CA1CA2CA4
SCHEMBL8084800 0.83 CA12 (0.40) TSHRCA12CA1CA2CA4
SCHEMBL18691517 0.80 CA12 (0.65) TSHRCA12CA1CA2CA4
SCHEMBL22064771 0.80 CA12 (0.65) TSHRCA12CA1CA2CA4
SCHEMBL23279935 0.80 PTGS2 (0.54) CA12CA1CA2CA4CA6
SCHEMBL8080435 0.80 MAPK1 (0.48) TSHRCA12CA1CA2CA4
SCHEMBL8081103 0.80 KDM4E (0.57) TSHRKDM4EMAPK1KMT2A
SCHEMBL3545163 0.80 KMT2A (0.58) TSHRCA12CA1CA2CA4
SCHEMBL8081661 0.79 ALDH1A1 (0.48) TSHRALDH1A1KDM4EGAAPOLB

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