SCHEMBL3957150

SCHEMBL3957150

O=CCCN(C1CCCCC1)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 11/20 0.44
ADH1C P00326 8/20 0.42
ADH4 P08319 2/20 0.40
ADH1B P00325 2/20 0.40
ADH7 P40394 1/20 0.40
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
GAA P10253 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
SCHEMBL15285433 0.84 ADH1A (0.39) ADH1AADH1CADH4ADH1BADH7
SCHEMBL29951006 0.78 ADH1A (0.48) ADH1AADH1CADH4ADH1BADH7
SCHEMBL10170019 0.77 ADH1A (0.39) ADH1AADH1CADH4ALDH1A1SMN1; SMN2
SCHEMBL29954517 0.76 ADH1A (0.45) ADH1AADH1CADH4ADH1BADH7
SCHEMBL30657708 0.75 ADH1A (0.50) ADH1AADH1CADH4ADH1BADH7
SCHEMBL27849876 0.74 ADH1C (0.30) ADH1AADH1CADH4
SCHEMBL29958626 0.72 ADH1A (0.47) ADH1AADH1CADH4ADH1BADH7
SCHEMBL10170018 0.72 SIGMAR1 (0.38) ADH1AADH1CALDH1A1SMN1; SMN2THRA
SCHEMBL95342 0.71 ADH1A (0.42) ADH1AADH1CADH4ADH1BADH7
SCHEMBL10171077 0.70 SIGMAR1 (0.41) ADH1AADH1CALDH1A1SMN1; SMN2THRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7560473-B2 Amine derivative with potassium channel regulatory function, its preparation and use INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES, P.L.A. (CN) 2009-07-14 US disclosed
US-20040266822-A1 Amine derivative with potassium channel regulatory function, its preparation and use INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. (CN) 2004-12-30 US disclosed
EP-1386908-A1 AMINE DERIVATIVE WITH POTASSIUM CHANNEL REGULATORY FUNCTION, ITS PREPARATION AND USE Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. (CN) 2004-02-04 EP disclosed
US-5239003-A PROCESS FOR PREPARATION OF STYRENE RESIN COMPOSITION AND STYRENE RESIN COMPOSITION NIPPON ZEON CO., LTD. (JP) 1993-08-24 US disclosed
US-5155161-A Living polymer modified by lactam, urea, amino ketone or aldehyde or thio analogs, followed by hydrolysis NIPPON ZEON CO., LTD. (JP) 1992-10-13 US disclosed
EP-0488346-A1 Process for preparation of styrene resin composition and styrene resin composition NIPPON ZEON CO., LTD. (JP) 1992-06-03 EP disclosed
US-4950719-A LOW TEMPERATURE VIBRATION INSULATOR NIPPON ZEON CO., LTD. (JP) 1990-08-21 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 (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-20040266822-A1 Amine derivative with potassium channel regulatory function, its preparation and use KCNMA1, KCNA5, KCNA1 ADH1A 451/4885ADH1C 328/4885ADH4 1158/4885

“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.