SCHEMBL10879375

SCHEMBL10879375

CCC(OC)Oc1ccccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
CA1 P00915 3/20 0.52
TP53 P04637 2/20 0.52
CA2 P00918 2/20 0.52
LMNA P02545 3/20 0.44
MAPT P10636 3/20 0.44
GAA P10253 2/20 0.44
JAK2 O60674 1/20 0.44
ALOX15 P16050 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
HSD17B10 Q99714 1/20 0.41
BCHE P06276 1/20 0.41
TYR P14679 1/20 0.41
ACHE P22303 1/20 0.41
APP P05067 1/20 0.36

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
SCHEMBL7596823 0.92 TSHR (0.50) TSHRCA1TP53CA2LMNA
SCHEMBL7559302 0.86 TSHR (0.52) TSHRCA1TP53CA2LMNA
SCHEMBL28098582 0.85 TSHR (0.44) TSHRCA1TP53CA2LMNA
SCHEMBL11142667 0.85 TP53 (0.48) TSHRCA1TP53CA2LMNA
SCHEMBL3170714 0.78 TSHR (0.48) TSHRCA1TP53CA2LMNA
SCHEMBL2349413 0.78 TSHR (0.48) TSHRCA1TP53CA2LMNA
SCHEMBL27752147 0.78 TSHR (0.44) TSHRCA1TP53CA2LMNA
SCHEMBL11229328 0.78 TSHR (0.44) TSHRCA1TP53CA2LMNA
SCHEMBL10878354 0.78 CA2 (0.58) TSHRCA1TP53CA2LMNA
SCHEMBL2021874 0.77 TSHR (0.47) TSHRCA1TP53CA2LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0083839-B1 PROCESS FOR PRODUCING INORGANIC FIBER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-03-05 EP disclosed
US-4495121-A SPINNING A POLYMETALOXANE, CALCINING SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1985-01-22 US disclosed
EP-0083839-A2 Process for producing inorganic fiber SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-07-20 EP disclosed
US-3950533-A Pyrocatechol carbamates and o-mercaptophenol carbamates and their use for combating pests CIBA-GEIGY AG (CH) 1976-04-13 US disclosed