SCHEMBL8512400

SCHEMBL8512400

CN=C=O.O=C=NCC1CCC2CC12

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
CASP1 P29466 1/20 0.32

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
SCHEMBL8037145 0.75
SCHEMBL2330759 0.74
SCHEMBL5013453 0.73 ALDH1A1 (0.31)
SCHEMBL19021594 0.70
SCHEMBL1901687 0.70
SCHEMBL1900904 0.70
SCHEMBL439502 0.70
SCHEMBL672876 0.70
SCHEMBL22899096 0.69
SCHEMBL29201843 0.68 TSHR (0.60) TSHRCASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3584265-B1 POLYCARBONATE POLYOL COMPOSITIONS SAUDI ARAMCO TECH CO (SA) 2023-03-15 EP disclosed
EP-2643374-B1 POLYCARBONATE POLYOL COMPOSITIONS SAUDI ARAMCO TECH CO (SA) 2019-09-18 EP disclosed
US-9029498-B2 Polycarbonate polyol compositions NOVOMER, INC. (US) 2015-05-12 US disclosed
US-20130337204-A1 POLYCARBONATE POLYOL COMPOSITIONS DSM IP ASSETS B.V. (NL) 2013-12-19 US disclosed
US-20130303724-A1 POLYCARBONATE POLYOL COMPOSITIONS DSM IP ASSETS B.V. (NL) 2013-11-14 US disclosed
EP-2643374-A1 POLYCARBONATE POLYOL COMPOSITIONS Novomer, Inc. (US) 2013-10-02 EP disclosed
EP-2643385-A1 POLYCARBONATE POLYOL COMPOSITIONS DSM IP Assets B.V. (NL) 2013-10-02 EP disclosed
WO-2012069523-A1 POLYCARBONATE POLYOL COMPOSITIONS DSM IP ASSETS B.V. (NL) 2012-05-31 WO disclosed
WO-2012071505-A1 POLYCARBONATE POLYOL COMPOSITIONS NOVOMER, INC. (US) 2012-05-31 WO disclosed