SCHEMBL2228173

SCHEMBL2228173

CCC(CC)(c1c2ccccc2c(C(CC)(CC)P(=O)(O)O)c2ccccc12)P(=O)(O)O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.41
TSHR P16473 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
ACP3 P15309 2/20 0.39
PTPN1 P18031 1/20 0.36
LAP3 P28838 4/20 0.36
ANPEP P15144 1/20 0.36
RIPK1 Q13546 1/20 0.36
PGK1 P00558 3/20 0.35
PGK2 P07205 3/20 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
SCHEMBL6305096 0.92 ACP3 (0.37) FDPSTSHRMEN1ALDH1A1GAA
SCHEMBL11764105 0.80 FDPS (0.39) FDPS
SCHEMBL1585204 0.79 TSHR (0.41) FDPSTSHRMEN1ALDH1A1GAA
SCHEMBL11762883 0.78 ACP3 (0.48) FDPSTSHRMEN1ALDH1A1GAA
SCHEMBL1556937 0.78 PTPN1 (0.52) FDPSTSHRMEN1ALDH1A1GAA
Hydrogen Peroxide SCHEMBL8609891 0.78 PTPN1 (0.52) FDPSTSHRMEN1ALDH1A1GAA
SCHEMBL3346090 0.77 ACP3 (0.61) MEN1KMT2AACP3PTPN1PGK1
SCHEMBL6703082 0.74 TSHR (0.38) FDPSTSHRMEN1ALDH1A1GAA
SCHEMBL1294409 0.74 ACP3 (0.42) MEN1ALDH1A1GAAKMT2AACP3
SCHEMBL7870277 0.74 PGK1 (0.44) FDPSTSHRMEN1ALDH1A1GAA

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-7985521-B2 Anthracene containing photoconductors XEROX CORPORATION (US) 2011-07-26 US claimed
US-20090297964-A1 ANTHRACENE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-03 US claimed
US-10731062-B2 Gas-generating material and micropump SEKISUI CHEMICAL CO., LTD. (JP) 2020-08-04 US disclosed
EP-2860167-B1 GAS GENERATING MATERIAL, AND MICROPUMP SEKISUI CHEMICAL CO LTD (JP) 2020-04-29 EP disclosed
EP-2907798-B1 GAS-GENERATING MATERIAL AND MICROPUMP SEKISUI CHEMICAL CO LTD (JP) 2019-02-06 EP disclosed
US-20150232714-A1 GAS-GENERATING MATERIAL AND MICROPUMP SEKISUI CHEMICAL CO., LTD. (JP) 2015-08-20 US disclosed
EP-2907798-A1 GAS-GENERATING MATERIAL AND MICROPUMP Sekisui Chemical Co., Ltd. (JP) 2015-08-19 EP disclosed
EP-2860167-A1 GAS GENERATING MATERIAL, AND MICROPUMP Sekisui Chemical Co., Ltd. (JP) 2015-04-15 EP disclosed
US-8986630-B2 Gas-generating material and micro pump SEKISUI CHEMICAL CO., LTD. (JP) 2015-03-24 US disclosed
US-20140161687-A1 GAS-GENERATING MATERIAL AND MICRO PUMP SEKISUI CHEMICAL CO., LTD. (JP) 2014-06-12 US disclosed
US-7985521-B2 Anthracene containing photoconductors XEROX CORPORATION (US) 2011-07-26 US disclosed
US-20090297964-A1 ANTHRACENE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-03 US disclosed
US-6875895-B2 Such as 1,4-bis(2-(4-bromophenyl)-2-phenylethenyl)-2-(2-ethylhexyloxy)-5 -methoxybenzene; for polymerization into a light-emitting material SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-04-05 US disclosed
US-20030100786-A1 Bis (diphenylvinyl) arene compound SUMITOMO CHEMICAL COMPANY, LIMITED 2003-05-29 US disclosed
EP-1288184-A1 Bis(diphenylvinyl)arene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-05 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030100786-A1 Bis (diphenylvinyl) arene compound CBR1, AR, CYP1B1 FDPS 3218/4885TSHR 3148/4885MEN1 3909/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.