SCHEMBL7239002

SCHEMBL7239002

CN(C)c1cccc(OCCCCl)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.54
MTNR1A P48039 7/20 0.47
MTNR1B P49286 7/20 0.47
NOS1 P29475 1/20 0.45
NOS2 P35228 1/20 0.45
FAAH O00519 1/20 0.44
CHRNB2 P17787 1/20 0.44
CHRNA4 P43681 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL8807486 0.95 APP (0.53) APPMTNR1AMTNR1BNOS1NOS2
SCHEMBL8805777 0.93 APP (0.54) APPMTNR1AMTNR1BNOS1NOS2
SCHEMBL31570769 0.93 APP (0.54) APPMTNR1AMTNR1BNOS1NOS2
SCHEMBL7455570 0.89 APP (0.60) APPMTNR1AMTNR1BNOS1NOS2
SCHEMBL7022072 0.86 FAAH (0.56) APPMTNR1AMTNR1BFAAHKMT2A
SCHEMBL10660855 0.84 TSHR (0.58) APPMTNR1AMTNR1BFAAH
SCHEMBL1428483 0.84 KDM4E (0.56) APPMTNR1AMTNR1BCHRNB2CHRNA4
SCHEMBL15965349 0.84 APP (0.53) APPMTNR1AMTNR1BNOS1NOS2
SCHEMBL5957100 0.84 MTNR1A (0.53) APPMTNR1AMTNR1BNOS1NOS2
SCHEMBL595463 0.84 APP (0.53) APPMTNR1AMTNR1BFAAHCHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3856749-B1 WATER-SOLUBLE, NON-AGGREGATED SILICON PHTALGCYANINE COMPOUND HAVING IN VITRO ANTICANCER EFFECT AGAINST CANCER TYPES OF LUNG, LIVER, BREST AND MELANOMA KARADENIZ TEKNIK UNIV (TR) 2024-05-01 EP claimed
EP-3856749-B1 WATER-SOLUBLE, NON-AGGREGATED SILICON PHTALGCYANINE COMPOUND HAVING IN VITRO ANTICANCER EFFECT AGAINST CANCER TYPES OF LUNG, LIVER, BREST AND MELANOMA KARADENIZ TEKNIK UNIV (TR) 2024-05-01 EP disclosed
EP-3856749-A1 WATER-SOLUBLE, NON-AGGREGATED SILICON PHTALGCYANINE COMPOUND HAVING IN VITRO ANTICANCER EFFECT AGAINST CANCER TYPES OF LUNG, LIVER, BREST AND MELANOMA Karadeniz Teknik Universitesi (TR) 2021-08-04 EP disclosed
WO-2020068015-A1 WATER-SOLUBLE, NON-AGGREGATED SILICON PHTALGCYANINE COMPOUND HAVING IN VITRO ANTICANCER EFFECT AGAINST CANCER TYPES OF LUNG, LIVER, BREST AND MELANOMA KARADENIZ TEKNIK UNIVERSITESI (TR) 2020-04-02 WO disclosed
US-6627648-B1 Relevant nicotinic receptor subtypes to any significant degree. central nervous system disorders, are treated by administering to a patient in need thereof amine derivatives TARGACEPT, INC. 2003-09-30 US disclosed
US-6441006-B2 NERVOUS SYSTEM DISORDERS TARGACEPT, INC. 2002-08-27 US disclosed
EP-1185513-A2 ARYL SUBSTITUTED ALKYLAMINES CAPABLE OF ACTIVATING NICOTINIC CHOLINERGIC RECEPTORS Targacept, Inc. (US) 2002-03-13 EP disclosed
US-20010031771-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE TARGACEPT, INC. 2001-10-18 US disclosed
US-20010014691-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE TARGACEPT, INC. 2001-08-16 US disclosed
WO-2000071520-A2 ARYL SUBSTITUTED ALKYLAMINES CAPABLE OF ACTIVATING NICOTINIC CHOLINERGIC RECEPTORS TARGACEPT, INC. (US) 2000-11-30 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 (2 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-20010031771-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE PNMT, TPMT, HTR7 APP 490/4885MTNR1A 236/4885MTNR1B 237/4885
US-20010014691-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE PNMT, HNMT, CHRM3 APP 325/4885MTNR1A 252/4885MTNR1B 165/4885

“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.