SCHEMBL7934547

SCHEMBL7934547

CCCCCCCC[Mg]CCCCCCCC.CCCC[Mg]CCCC

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.53
THRB P10828 1/20 0.53
DNM1 Q05193 7/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 1/20 0.40
SLC22A1 O15245 1/20 0.40
EPHX1 P07099 1/20 0.40

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
SCHEMBL10456942 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL653543 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL7183127 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL24173 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL9418531 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL10979448 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL10899103 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL943342 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL10603360 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA
Heptane SCHEMBL27288990 1.00 TSHR (0.53) TSHRTHRBDNM1ALDH1A1LMNA

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
US-6271164-B1 METALLOCENE CATALYST LYONDELL CHEMICAL TECHNOLOGY, L.P. 2001-08-07 US disclosed
EP-0127980-B1 POLYMERISATION OF CONJUGATED DIENES ENICHEM ELASTOMERS LIMITED (GB) 1987-08-19 EP disclosed
US-4520177-A CATALYST COMPRISING RARE EARTH COMPOUND, ORGANOMAGNESIUM, AND LEWIS ACID ENICHEM ELASTOMERS LIMITED, A COMPANY OF BRITISH (JE) 1985-05-28 US disclosed
EP-0127980-A1 Polymerisation of conjugated dienes ENICHEM ELASTOMERS LIMITED (GB) 1984-12-12 EP disclosed
US-4069267-A Stable diorganomagnesium compositions LITHIUM CORPORATION OF AMERICA (US) 1978-01-17 US disclosed