SCHEMBL10685233

SCHEMBL10685233

CCCCCCCCCCCCCCCCCCC1(N)CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
THRB P10828 1/20 0.36
DNM1 Q05193 7/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
EPHX1 P07099 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.34
CETP P11597 2/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL15375296 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL6061239 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL15375292 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL3673746 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL6063488 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL1485626 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL6062501 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL1485789 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL6061746 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A
SCHEMBL6061592 1.00 TSHR (0.36) TSHRTHRBDNM1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018162205-A1 ONE COMPONENT COMPOSITION BASED ON COMPOUNDS WITH AT LEAST TWO EXO-VINYLENE CYCLIC CARBONATE UNITS HENKEL AG & CO. KGAA (DE) 2018-09-13 WO disclosed
EP-3372624-A1 ONE COMPONENT COMPOSITION BASED ON COMPOUNDS WITH AT LEAST TWO EXO-VINYLENE CYCLIC CARBONATE UNITS Henkel AG & Co. KGaA (DE) 2018-09-12 EP disclosed
US-4788277-A OXIDATIVE COUPLING, CATALYST CONTAINING COPPER, DIAMINE, HALOGEN ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1988-11-29 US disclosed
US-4098846-A IMPACT STRENGTH GENERAL ELECTRIC COMPANY (US) 1978-07-04 US disclosed
US-4054553-A MANGANESE COMPLEX CATALYST GENERAL ELECTRIC COMPANY (US) 1977-10-18 US disclosed