SCHEMBL398301

SCHEMBL398301

CCCNC(CCC)Cc1cc2ccccc2o1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.44
CYP2D6 P10635 1/20 0.43
HIF1A Q16665 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
SIGMAR1 Q99720 2/20 0.42
AGXT P21549 1/20 0.41
PSMB5 P28074 2/20 0.40
PSMB8 P28062 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PIN1 Q13526 1/20 0.39
HDAC3 O15379 1/20 0.38
ADRA2A P08913 1/20 0.36
HTR1A P08908 3/20 0.36
HTR2B P41595 3/20 0.36
FCER2 P06734 1/20 0.36

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
SCHEMBL2486381 1.00 LOXL2 (0.44) LOXL2CYP2D6HIF1AMAOAMAOB
Hydrochloric Acid SCHEMBL2488027 0.99 LOXL2 (0.43) LOXL2CYP2D6HIF1AMAOAMAOB
Hydrochloric Acid SCHEMBL2488414 0.99 LOXL2 (0.43) LOXL2CYP2D6HIF1AMAOAMAOB
Hydrochloric Acid SCHEMBL2488024 0.99 LOXL2 (0.43) LOXL2CYP2D6HIF1AMAOAMAOB
SCHEMBL30457900 0.77 TAS1R3 (0.50) LOXL2AGXTPSMB5PSMB8TAS1R3
SCHEMBL4436085 0.76 CYP2D6 (0.44) LOXL2CYP2D6HIF1AMAOAMAOB
SCHEMBL4340930 0.76 CYP2D6 (0.44) LOXL2CYP2D6HIF1AMAOAMAOB
SCHEMBL19550896 0.74 LOXL2 (0.43) LOXL2CYP2D6HIF1AMAOAMAOB
SCHEMBL30458044 0.74 SIGMAR1 (0.49) LOXL2CYP2D6HIF1AMAOBSIGMAR1
SCHEMBL30457823 0.74 SIGMAR1 (0.49) LOXL2CYP2D6HIF1AMAOBSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3087984-B1 PROPHYLACTIC AND THERAPEUTIC AGENT FOR ATTENTION-DEFICIT/HYPERACTIVITY DISORDER FUJIMOTO CO LTD (JP) 2021-04-07 EP claimed
EP-3226852-B1 ARYLALKYLAMINE COMPOUNDS FOR USE IN THE PREVENTION OR TREATMENT OF CANCER SEMMELWEIS UNIV (HU) 2020-03-18 EP claimed
US-10258599-B2 Compounds for use in the prevention or treatment of cancer SEMMELWEIS UNIVERSITY (HU) 2019-04-16 US claimed
US-20170319535-A1 COMPOUNDS FOR USE IN THE PREVENTION OR TREATMENT OF CANCER SEMMELWEIS UNIVERSITY (HU) 2017-11-09 US claimed
US-9782383-B2 Prophylactic and therapeutic agent for attention-deficit/hyperactivity disorder FUJIMOTO CO., LTD. (JP) 2017-10-10 US claimed
EP-3087984-A1 PROPHYLACTIC AND THERAPEUTIC AGENT FOR ATTENTION-DEFICIT/HYPERACTIVITY DISORDER Fujimoto Co., Ltd. (JP) 2016-11-02 EP claimed
US-20160296495-A1 PROPHYLACTIC AND THERAPEUTIC AGENT FOR ATTENTION-DEFICIT/HYPERACTIVITY DISORDER FUJIMOTO CO., LTD. (JP) 2016-10-13 US claimed
EP-2158908-B1 COMPOSITION FOR TRANSDERMAL ADMINISTRATION FUJIMOTO CO LTD (JP) 2013-04-24 EP claimed
US-20130005800-A1 COMPOSITION FOR TRANSDERMAL OR TRANSMUCOSAL ADMINISTRATION YONEDA FUMIO (JP) 2013-01-03 US claimed
US-8318799-B2 Therapeutic agent for substance dependence NATIONAL UNIVERSITY CORPORATION KYUSHU UNIVERSITY (JP) 2012-11-27 US claimed
EP-2158908-A1 COMPOSITION FOR TRANSDERMAL OR TRANSMUCOSAL ADMINISTRATION Fujimoto Co., Ltd. (JP) 2010-03-03 EP claimed
EP-1815853-B1 THERAPEUTIC AGENT ((-)-BPAP) FOR DRUG DEPENDENCE UNIV KYUSHU NAT UNIV CORP (JP) 2009-04-22 EP claimed
US-20080004337-A1 Therapeutic Agent for Substance Dependence FUJIMOTO CO., LTD. (JP) 2008-01-03 US claimed
EP-1815853-A1 THERAPEUTIC AGENT FOR DRUG DEPENDENCE Kyushu University, National University Corporation (JP) 2007-08-08 EP claimed
EP-1052259-B1 NOVEL OPTICALLY ACTIVE AMINOPENTANE DERIVATIVE FUJIMOTO BROTHERS CO LTD (JP) 2007-04-18 EP claimed
EP-0957080-B1 NOVEL ETHYLAMINE DERIVATIVES FUJIMOTO BROTHERS CO LTD (JP) 2006-06-21 EP claimed
US-6391914-B1 NEUROTRANSMITTERS; PSYCHOLOGICAL DISORDERS, ANTIDEPRESSANTS;THERAPY FOR PARKINSON'S AND ALZHEIMER'S DISEASE FUJIMOTO BROTHERS CO., LTD. (JP) 2002-05-21 US claimed
US-6214859-B1 PSYCHOLOGICAL DISORDERS; ALZHEIMER'S DISORDERS; PARKINSON'SDISORDERS FUJIMOTO BROTHERS CO., LTD. (JP) 2001-04-10 US claimed
EP-1052259-A1 NOVEL OPTICALLY ACTIVE AMINOPENTANE DERIVATIVE Fujimoto Brothers Co., Ltd. (JP) 2000-11-15 EP claimed
EP-0957080-A1 NOVEL ETHYLAMINE DERIVATIVES Fujimoto Brothers Co., Ltd. (JP) 1999-11-17 EP claimed

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

For each of this compound's patents that has machine-readable text (5 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-20080004337-A1 Therapeutic Agent for Substance Dependence OPRM1, GABARAP, OPRK1 LOXL2 2155/4885CYP2D6 1404/4885HIF1A 889/4885
US-20130005800-A1 COMPOSITION FOR TRANSDERMAL OR TRANSMUCOSAL ADMINISTRATION APP, GAP43, PSEN1 LOXL2 3215/4885CYP2D6 45/4885HIF1A 4337/4885
US-10258599-B2 Compounds for use in the prevention or treatment of cancer TMSB10, PNMT, HNMT LOXL2 4402/4885CYP2D6 3599/4885HIF1A 692/4885
US-20170319535-A1 COMPOUNDS FOR USE IN THE PREVENTION OR TREATMENT OF CANCER TMSB10, PNMT, HNMT LOXL2 4454/4885CYP2D6 3495/4885HIF1A 646/4885
US-20160296495-A1 PROPHYLACTIC AND THERAPEUTIC AGENT FOR ATTENTION-DEFICIT/HYPERACTIVITY DISORDER SLC6A2, SLC6A3, SLC6A4 LOXL2 4400/4885CYP2D6 893/4885HIF1A 3428/4885

“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.