SCHEMBL7397348

SCHEMBL7397348

C=C[C](I)[Sn](CCCC)(CCCC)CCCC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31

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
SCHEMBL3355262 0.74 TSHR (0.35) TSHRALDH1A1HPGDZDHHC20ZDHHC2
SCHEMBL9464579 0.73 TSHR (0.42) TSHRALDH1A1HPGDZDHHC20ZDHHC2
SCHEMBL437089 0.67 TSHR (0.33) TSHRALDH1A1
SCHEMBL203812 0.67 TSHR (0.33) TSHRALDH1A1
SCHEMBL16671361 0.65
SCHEMBL16667046 0.65
SCHEMBL4782406 0.65
SCHEMBL4782408 0.65
SCHEMBL1028079 0.64 TSHR (0.38) TSHRALDH1A1
SCHEMBL1899483 0.64 ALDH1A1 (0.30) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0734385-B1 SUBSTITUTED 2-CARBOXYALKYL-3-(FLUOROPHENYL)-8-(3-HALOPROPEN-2-YL) NORTROPANES AND THEIR USE AS IMAGING AGENTS FOR NEURODEGENERATIVE DISORDERS GEN HOSPITAL CORP (US) 2002-04-17 EP disclosed
EP-1081147-A2 Substituted nortropanes and their use as imaging agents for neurodegenerative disorders THE GENERAL HOSPITAL CORPORATION (US) 2001-03-07 EP disclosed
US-5853696-A Substituted 2-carboxyalkyl-3(fluorophenyl)-8-(3-halopropen-2-yl) nortropanes and their use as imaging agents for neurodegenerative disorders ORGANIX, INC. (US) 1998-12-29 US disclosed
EP-0734385-A4 SUBSTITUTED 2-CARBOXYALKYL-3-(FLUOROPHENYL)-8-(3-HALOPROPEN-2-YL) NORTROPANES AND THEIR USE AS IMAGING AGENTS FOR NEURODEGENERATIVE DISORDERS GEN HOSPITAL CORP (US) 1997-05-07 EP disclosed
EP-0734385-A1 SUBSTITUTED 2-CARBOXYALKYL-3-(FLUOROPHENYL)-8-(3-HALOPROPEN-2-YL) NORTROPANES AND THEIR USE AS IMAGING AGENTS FOR NEURODEGENERATIVE DISORDERS THE GENERAL HOSPITAL CORPORATION (US) 1996-10-02 EP disclosed
US-5493026-A LABELED WITH RADIOACTIVE ISOTOPES FOR TOMOGRAPHY ORGANIX, INC. (US) 1996-02-20 US disclosed
WO-1995011901-A9 SUBSTITUTED 2-CARBOXYALKYL-3-(FLUOROPHENYL)-8-(3-HALOPROPEN-2-YL) NORTROPANES AND THEIR USE AS IMAGING AGENTS FOR NEURODEGENERATIVE DISORDERS 1995-06-15 WO disclosed
WO-1995011901-A1 SUBSTITUTED 2-CARBOXYALKYL-3-(FLUOROPHENYL)-8-(3-HALOPROPEN-2-YL) NORTROPANES AND THEIR USE AS IMAGING AGENTS FOR NEURODEGENERATIVE DISORDERS THE GENERAL HOSPITAL CORPORATION (US) 1995-05-04 WO disclosed