SCHEMBL6900939

SCHEMBL6900939

CCCOCCCCCCCCOCCC

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.55
THRB P10828 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
MAPT P10636 1/20 0.55
TSHR P16473 3/20 0.48
USP2 O75604 1/20 0.46
CES2 O00748 2/20 0.44
SPHK2 Q9NRA0 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP3A4 P08684 1/20 0.40
CES1 P23141 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LPAR5 Q9H1C0 1/20 0.38
EPHX2 P34913 2/20 0.37

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
SCHEMBL2512982 1.00 HTT (0.55) HTTTHRBMEN1KMT2AMAPT
SCHEMBL9011593 1.00 HTT (0.55) HTTTHRBMEN1KMT2AMAPT
SCHEMBL6902801 1.00 HTT (0.55) HTTTHRBMEN1KMT2AMAPT
SCHEMBL6901331 1.00 HTT (0.55) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2511487 1.00 HTT (0.55) HTTTHRBMEN1KMT2AMAPT
SCHEMBL6897104 1.00 HTT (0.55) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2551087 0.96 TSHR (0.50) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2323645 0.96 TSHR (0.50) HTTTHRBMEN1KMT2AMAPT
SCHEMBL87529 0.94 HTT (0.64) HTTTHRBMEN1KMT2AMAPT
SCHEMBL1931398 0.94 HTT (0.64) HTTTHRBMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113574041-A Method for producing bisphenol and method for producing polycarbonate resin 三菱化学株式会社 2021-10-29 CN disclosed
EP-2735581-B1 COMPOSITION AND POLYMER ASAHI CHEMICAL IND (JP) 2021-07-14 EP disclosed
US-9738757-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2017-08-22 US disclosed
US-20160222168-A1 Composition and Polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-08-04 US disclosed
US-9334371-B2 Composition and polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-05-10 US disclosed
EP-2735581-A1 COMPOSITION AND POLYMER Asahi Kasei Chemicals Corporation (JP) 2014-05-28 EP disclosed
US-20140121293-A1 Composition and Polymer ASAHI KASEI CHEMICALS CORPORATION (JP) 2014-05-01 US disclosed
EP-1284979-B1 PREPOLYMERIC (METH)ACRYLATES WITH POLYCYCLIC OR AROMATIC SEGMENTS 3M ESPE AG (DE) 2004-12-29 EP disclosed
EP-1139973-B1 POLYMERISABLE MATERIALS WHICH ARE BASED ON HARDENABLE SILOXANE COMPOUNDS 3M ESPE AG (DE) 2003-04-23 EP disclosed
US-5529874-A ETHER CARRIER LIQUID AND TONER PARTICLES DISPERSED THEREIN; SUITABLE FOR HIGH SPEED COPYING FUJI XEROX CO., LTD. (JP) 1996-06-25 US disclosed