SCHEMBL9225007

SCHEMBL9225007

CCCCCCCCCCCCCCCCCC[Ti](Br)(Br)Br

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
THRB P10828 1/20 0.50
DNM1 Q05193 7/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC22A1 O15245 1/20 0.38
EPHX1 P07099 1/20 0.38

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
SCHEMBL7592591 0.87
SCHEMBL11053786 0.73 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL1602019 0.73 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL9243081 0.73 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL391963 0.73 TSHR (0.57) TSHRTHRBDNM1ALDH1A1LMNA
Dodecane SCHEMBL27908228 0.71 TSHR (0.80) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL23854647 0.71 TSHR (1.00) TSHRTHRBDNM1ALDH1A1LMNA
Tetradecane SCHEMBL25387874 0.71 TSHR (1.00) TSHRTHRBDNM1ALDH1A1LMNA
Dodecane SCHEMBL4052434 0.71 TSHR (1.00) TSHRTHRBDNM1ALDH1A1LMNA
Decane SCHEMBL23499900 0.71 TSHR (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0498335-B1 Method of manufacturing chemically adsorbed film MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 1995-08-09 EP disclosed
US-5270080-A Method of manufacturing chemically adsorbed film MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1993-12-14 US disclosed
EP-0498335-A1 Method of manufacturing chemically adsorbed film MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1992-08-12 EP disclosed