SCHEMBL5133441

SCHEMBL5133441

CCCCCCCNC(=N)NC(=N)N

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.47
SPHK1 Q9NYA1 5/20 0.46
SPHK2 Q9NRA0 1/20 0.43
CASP2 P42575 1/20 0.42
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
NAAA Q02083 1/20 0.40
RRM1 P23921 1/20 0.39

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
SCHEMBL1428105 1.00 EPHX1 (0.47) EPHX1SPHK1SPHK2CASP2MEN1
SCHEMBL4111428 1.00 EPHX1 (0.47) EPHX1SPHK1SPHK2CASP2MEN1
Polihexanide SCHEMBL45011 1.00 EPHX1 (0.47) EPHX1SPHK1SPHK2CASP2MEN1
SCHEMBL245909 1.00 EPHX1 (0.47) EPHX1SPHK1SPHK2CASP2MEN1
SCHEMBL3921623 1.00 EPHX1 (0.47) EPHX1SPHK1SPHK2CASP2MEN1
Hydrochloric Acid SCHEMBL9667167 0.98 SPHK1 (0.49) EPHX1SPHK1SPHK2CASP2MEN1
Hydrochloric Acid SCHEMBL8898546 0.98 SPHK1 (0.49) EPHX1SPHK1SPHK2CASP2MEN1
Polihexanide SCHEMBL115297 0.98 SPHK1 (0.49) EPHX1SPHK1SPHK2CASP2MEN1
Polihexanide SCHEMBL6770315 0.98 EPHX1 (0.45) EPHX1SPHK1SPHK2CASP2MEN1
Polihexanide SCHEMBL8515092 0.98 SPHK1 (0.49) EPHX1SPHK1SPHK2CASP2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3083862-B1 ANTIMICROBIAL PRESSURE-SENSITIVE ADHESIVE SYSTEM 3M INNOVATIVE PROPERTIES CO (US) 2020-08-05 EP claimed
US-8563011-B2 Use of low molecular weight amino alcohols in ophthalmic compositions ALCON RESEARCH, LTD. (US) 2013-10-22 US claimed
CN-115746855-A Treatment liquid 富士胶片株式会社 2023-03-07 CN disclosed
CN-109844008-B Rubber composition and crosslinked rubber 日本瑞翁株式会社 2021-08-24 CN disclosed
US-10898857-B2 Membranes with alternative selective layers Oasys Water LLC (US) 2021-01-26 US disclosed
CN-108485840-B Cleaning formulation for removing residues on surfaces 富士胶片电子材料美国有限公司 2020-12-29 CN disclosed
US-20190217249-A1 MEMBRANES WITH ALTERNATIVE SELECTIVE LAYERS CHINA CAMC ENGINEERING HONGKONG CO., LIMITED (HK) 2019-07-18 US disclosed
WO-2018049013-A1 MEMBRANES WITH ALTERNATIVE SELECTIVE LAYERS OASYS WATER, INC. (US) 2018-03-15 WO disclosed
EP-3071319-A1 SYSTEMS AND METHODS FOR REPAIRING MEMBRANES AND IMPROVING PERFORMANCE OF OSMOTICALLY DRIVEN MEMBRANE SYSTEMS Oasys Water, Inc. (US) 2016-09-28 EP disclosed
US-20150136676-A1 SYSTEMS AND METHODS FOR REPAIRING MEMBRANES AND IMPROVING PERFORMANCE OF OSMOTICALLY DRIVEN MEMBRANE SYSTEMS Oasys Water LLC 2015-05-21 US disclosed
US-20140322287-A1 BIOACTIVE COATINGS BIOINTERACTIONS LTD. (GB) 2014-10-30 US disclosed
US-7045095-B2 Efficiency microbiocides, preservatives; mixture containing sodium borarte; antiseptic for contact lenses ALCON MANUFACTURING, LTD. (US) 2006-05-16 US disclosed
US-20050239900-A1 Efficiency microbiocides, preservatives; mixture containing sodium borarte; antiseptic for contact lenses ALCON RESEARCH, LTD. 2005-10-27 US disclosed
US-6949218-B2 Enhancing the anti-microbial activity of a borate-containing compound which comprises adding to the composition an effective amount of a low molecular weight amino alcohol, wherein the amino alcohol has a molecular weight of 60-200 ALCON MANUFACTURING, LTD. (US) 2005-09-27 US disclosed
US-20020106304-A1 Enhancing the anti-microbial activity of a borate-containing compound which comprises adding to the composition an effective amount of a low molecular weight amino alcohol, wherein the amino alcohol has a molecular weight of 60-200 ALCON RESEARCH, LTD. 2002-08-08 US disclosed
EP-0948357-B1 USE OF LOW MOLECULAR WEIGHT AMINO ALCOHOLS IN OPHTHALMIC COMPOSITIONS ALCON LAB INC (US) 2002-06-12 EP disclosed
EP-1190718-A2 Ophthalmic compositions comprising amino alcohols ALCON LABORATORIES, INC. (US) 2002-03-27 EP disclosed
US-6319464-B1 ADDED TO BORATE CONTAINING COMPOUND; ANTIMICROBIAL ACTIVITY ENHANCEMENT ALCON MANUFACTURING, LTD. 2001-11-20 US disclosed
EP-0948357-A1 USE OF LOW MOLECULAR WEIGHT AMINO ALCOHOLS IN OPHTHALMIC COMPOSITIONS ALCON LABORATORIES, INC. (US) 1999-10-13 EP disclosed
WO-1998025649-A1 USE OF LOW MOLECULAR WEIGHT AMINO ALCOHOLS IN OPHTHALMIC COMPOSITIONS ALCON LABORATORIES, INC. (US) 1998-06-18 WO 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-20140322287-A1 BIOACTIVE COATINGS SERPINC1, PLAT, FGB EPHX1 2337/4885SPHK1 3312/4885SPHK2 3827/4885

“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.