SCHEMBL8088836

SCHEMBL8088836

C1=CC2CCC1C2.C1=CC2CCC1C2.C=CCCCC

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
ALDH1A1 P00352 1/20 0.56

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
SCHEMBL8415839 1.00 TSHR (0.56) TSHRALDH1A1
Ethylene SCHEMBL27411688 0.98 TSHR (0.54) TSHRALDH1A1
SCHEMBL8632662 0.92 TSHR (0.59) TSHRALDH1A1
SCHEMBL22203987 0.92 TSHR (0.59) TSHRALDH1A1
Butane SCHEMBL27875905 0.75
SCHEMBL5606382 0.75 TSHR (1.00) TSHRALDH1A1
SCHEMBL2405672 0.75 TSHR (1.00) TSHRALDH1A1
SCHEMBL9420916 0.75 TSHR (1.00) TSHRALDH1A1
SCHEMBL2137 0.75
SCHEMBL2568509 0.75 TSHR (1.00) TSHRALDH1A1

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-6121340-A MIXTURE CONTAINING PHOTOINITIATOR THE B. F. GOODRICH COMPANY (US) 2000-09-19 US disclosed
US-6031058-A POLYMERS OF THE INVENTION INCLUDE POLYCYCLIC REPEAT UNITS THAT CONTAIN PENDANT SILYL FUNCTIONAL GROUPS THE B.F. GOODRICH COMPANY (US) 2000-02-29 US disclosed