SCHEMBL3890686

SCHEMBL3890686

CC(C)C(OP(=O)(O)O)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 1/20 0.38
SMPD1 P17405 3/20 0.37
FDPS P14324 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
CA9 Q16790 1/20 0.35
CTSA P10619 1/20 0.33
ACHE P22303 1/20 0.33
METAP1 P53582 1/20 0.30

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
SCHEMBL5963773 0.87 SMPD1 (0.33) LAP3SMPD1FDPSBLMTDP1
SCHEMBL16688120 0.82 LAP3 (0.38) LAP3CA2CA12CA1MMP1
SCHEMBL12960884 0.77 LAP3 (0.38) LAP3SMPD1FDPSBLMTDP1
SCHEMBL2475819 0.77 LAP3 (0.38) LAP3SMPD1FDPSBLMTDP1
SCHEMBL3898905 0.76 SMPD1 (0.42) LAP3SMPD1FDPSBLMTDP1
SCHEMBL5671571 0.75 CTSA (0.36) CTSAACHE
Phosphorylisopropane SCHEMBL82996 0.75
SCHEMBL10447789 0.75 SMPD1 (0.39) LAP3SMPD1FDPSBLMTDP1
SCHEMBL5963622 0.75 SMPD1 (0.39) LAP3SMPD1FDPSBLMTDP1
SCHEMBL31316283 0.74 LAP3 (0.36) LAP3SMPD1FDPSBLMTDP1

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 68 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116745025-A membrane for water filtration 水通道蛋白有限公司 2023-09-12 CN disclosed
US-20230151024-A1 STING AGONISTIC COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2023-05-18 US disclosed
US-20230150941-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHOLOGICAL DISORDERS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2023-05-18 US disclosed
US-20230141284-A1 CANCER THERAPEUTIC METHOD ONO PHARMACEUTICAL CO., LTD. (JP) 2023-05-11 US disclosed
US-10040787-B2 Prodrugs of NH-acidic compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2018-08-07 US disclosed
US-10036838-B2 Infrared ray absorbing composition or infrared ray absorbing composition kit, infrared ray cut filter using the same, method for producing the infrared ray cut filter, camera module, and method for producing the camera module FUJIFILM CORPORATION (JP) 2018-07-31 US disclosed
US-10023537-B2 Heterocyclic compounds for the treatment of neurological and psychological disorders ALKERMES PHARMA IRELAND LIMITED (IE) 2018-07-17 US disclosed
US-10011569-B2 Process for synthesizing oxidized lactam compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2018-07-03 US disclosed
US-20180162816-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHOLOGICAL DISORDERS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2018-06-14 US disclosed
US-9810821-B2 Infrared ray cutoff filter FUJIFILM CORPORATION (JP) 2017-11-07 US disclosed
US-6905031-B1 Solid phase microextraction device using aerogel THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-06-14 US disclosed
US-20050044778-A1 Fuel compositions employing catalyst combustion structure OCTANE INTERNATIONAL, LTD. 2005-03-03 US disclosed
US-20040237384-A1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2004-12-02 US disclosed
US-6652608-B1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2003-11-25 US disclosed
US-20030022389-A1 Chemical specific adsorption aerogel for sample collection THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-01-30 US disclosed
EP-0954558-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR, William C. (US) 1999-11-10 EP disclosed
WO-1998026028-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 1998-06-18 WO disclosed
US-4433975-A HETEROCYCLIC QUATERNARY AMMONIUM PHOSPHATES CIBA-GEIGY CORPORATION (US) 1984-02-28 US disclosed
US-4432886-A 2-FURANYLBENZIMIDAZOLE, OR 2-AZOLYLBENZIMIDAZOLE, OR 2-STILBENYLBENZIMIDAZOLE, OR 2,5-(BENZIMIDAZOLYL)FURAN PHOSPHATES CIBA-GEIGY CORPORATION (US) 1984-02-21 US disclosed
US-4384121-A WATER SOLUBLE CIBA-GEIGY CORPORATION (US) 1983-05-17 US 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 (7 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-20230141284-A1 CANCER THERAPEUTIC METHOD STING1, CGAS, IFNAR1 LAP3 2792/4885SMPD1 625/4885FDPS 2926/4885
US-10011569-B2 Process for synthesizing oxidized lactam compounds COASY, DHPS, OXA1L LAP3 2828/4885SMPD1 2708/4885FDPS 29/4885
US-20180162816-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHOLOGICAL DISORDERS GABBR1, GABBR2, GABRE LAP3 3745/4885SMPD1 2207/4885FDPS 494/4885
US-10023537-B2 Heterocyclic compounds for the treatment of neurological and psychological disorders GABBR1, GABBR2, GABRE LAP3 3745/4885SMPD1 2207/4885FDPS 494/4885
US-10040787-B2 Prodrugs of NH-acidic compounds SI, NAAA, NIT2 LAP3 114/4885SMPD1 327/4885FDPS 809/4885
US-20230150941-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHOLOGICAL DISORDERS GABBR1, GABBR2, GABRE LAP3 3745/4885SMPD1 2207/4885FDPS 494/4885
US-20230151024-A1 STING AGONISTIC COMPOUND STING1, CGAS, TLR1 LAP3 2896/4885SMPD1 274/4885FDPS 2443/4885

“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.