SCHEMBL2987452

SCHEMBL2987452

c1csc(CCOC2CCCCO2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
HRH3 Q9Y5N1 2/20 0.40
POLB P06746 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
HPGD P15428 2/20 0.37
CYP3A4 P08684 1/20 0.35

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
SCHEMBL2084894 0.92 KMT2A (0.47) KDM4CL3MBTL1NPC1RAB9AKMT2A
SCHEMBL6042775 0.83 KMT2A (0.45) KDM4CL3MBTL1NPC1RAB9AKMT2A
SCHEMBL6042771 0.83 KMT2A (0.45) KDM4CL3MBTL1NPC1RAB9AKMT2A
SCHEMBL6879618 0.77 KDM4C (0.58) KDM4CL3MBTL1NPC1RAB9AKMT2A
SCHEMBL2082741 0.75 KDM4C (0.47) KDM4CL3MBTL1NPC1RAB9AKMT2A
SCHEMBL25357851 0.75 KDM4C (0.47) KDM4CL3MBTL1NPC1RAB9AKMT2A
SCHEMBL13209028 0.75 KDM4C (0.47) KDM4CL3MBTL1NPC1RAB9AKMT2A
SCHEMBL26066505 0.75 KDM4C (0.47) KDM4CL3MBTL1NPC1RAB9AKMT2A
SCHEMBL10341111 0.75 HRH3 (0.37) KDM4CNPC1RAB9AKMT2AMEN1
SCHEMBL26066468 0.73 KDM4C (0.45) KDM4CL3MBTL1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227566-B2 Polythiophenes, block copolymers made therefrom, and methods of forming the same CARNEGIE MELLON UNIVERSITY (US) 2012-07-24 US disclosed
US-8227566-B2 Polythiophenes, block copolymers made therefrom, and methods of forming the same CARNEGIE MELLON UNIVERSITY (US) 2012-07-24 US disclosed
US-RE41587-E1 Polythiophenes, block copolymers made therefrom, and methods of forming the same CARNEGIE MELLON UNIVERSITY (US) 2010-08-24 US disclosed
US-RE41587-E1 Polythiophenes, block copolymers made therefrom, and methods of forming the same CARNEGIE MELLON UNIVERSITY (US) 2010-08-24 US disclosed
US-RE40813-E1 Polythiophenes, block copolymers made therefrom, and methods of forming the same CARNEGIE MELLON UNIVERSITY (US) 2009-06-30 US disclosed
US-RE40813-E1 Polythiophenes, block copolymers made therefrom, and methods of forming the same CARNEGIE MELLON UNIVERSITY (US) 2009-06-30 US disclosed
US-7098294-B2 Stereospecific electroconductive polymers such as polyhexylthiophene-polystyrene or -polymethylacrylate copolymers, used as light emitting diodes, biosensors, transistors, displays or optical apparatus CARNEGIE MELLON UNIVERSITY (US) 2006-08-29 US disclosed
US-20050187370-A1 Regioregular head-to-tail poly(3-alkylthiophenes) conductive segments; electroconductivity, mechanical properties; television, light emitting diodes, biosensors, transistors, rechargeable batteries, medical equipment, prosthetics, electronics, phones CARNEGIE MELLON UNIVERSITY 2005-08-25 US disclosed
US-6887965-B2 Lightweight, electroconductivity, heat resistance CARNEGIE MELLON UNIVERSITY (US) 2005-05-03 US disclosed
US-20040030091-A1 Lightweight, electroconductivity, heat resistance MCCULLOUGH RICHARD D (US) 2004-02-12 US disclosed
US-20040024171-A1 Stereospecific electroconductive polymers such as polyhexylthiophene-polystyrene or -polymethylacrylate copolymers, used as light emitting diodes, biosensors, transistors, displays or optical apparatus MCCULLOUGH RICHARD D (US) 2004-02-05 US disclosed
US-6602974-B1 Conducting polymers, head-to-tail coupled regioregular polythiophenes, poly-(3-substituted) thiophene diol CARNEGIE MELLON UNIVERSITY 2003-08-05 US disclosed
EP-0221806-B1 SUBSTITUTED THIOPHENE-2-SULFANOMIDE AND ANTIGLAUCOMA COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1990-01-10 EP disclosed
EP-0221806-A1 Substituted thiophene-2-sulfanomide and antiglaucoma compositions containing them MERCK & CO. INC. (US) 1987-05-13 EP disclosed
US-4665090-A TOPICAL ADMINISTRATION MERCK & CO., INC. (US) 1987-05-12 US disclosed