SCHEMBL516032

SCHEMBL516032

NCC(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.56
TAAR1 Q96RJ0 4/20 0.52
SLC6A2 P23975 2/20 0.52
CYP2A6 P11509 2/20 0.52
MAOA P21397 1/20 0.52
SLC6A4 P31645 1/20 0.52
SLC6A3 Q01959 1/20 0.52
SIGMAR1 Q99720 1/20 0.52
ADORA2A P29274 1/20 0.52
ADORA1 P30542 1/20 0.52
LOXL2 Q9Y4K0 2/20 0.50
ANPEP P15144 2/20 0.48
CYP2D6 P10635 1/20 0.48
ALPI P09923 1/20 0.46
PKM P14618 1/20 0.46
PTGS1 P23219 1/20 0.46
XIAP P98170 1/20 0.46
SLC7A5 Q01650 1/20 0.46
HTR2A P28223 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL6563096 0.95 EPHX1 (0.56) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL1677656 0.87 SLC6A2 (0.55) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL29822049 0.86 TRPA1 (0.50) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL353179 0.86 TRPA1 (0.50) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL5689338 0.86 TRPA1 (0.50) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL4588322 0.86 TAAR1 (0.50) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL11517810 0.86 EPHX1 (0.48) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL353629 0.86 EPHX1 (0.48) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL2604897 0.86 TAAR1 (0.50) EPHX1TAAR1SLC6A2CYP2A6MAOA
SCHEMBL4981467 0.83 EPHX1 (0.60) EPHX1TAAR1SLC6A2CYP2A6MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4352449-B1 PROJECTILE PAYLOAD FOR TRAINING AMMUNITION WITH MULTI-SPECTRAL OUTPUT CYALUME TECH INC (US) 2025-05-07 EP claimed
EP-4352449-A2 PROJECTILE PAYLOAD FOR TRAINING AMMUNITION WITH MULTI-SPECTRAL OUTPUT Cyalume Technologies, Inc (US) 2024-04-17 EP claimed
US-11940253-B2 Projectile payload for training ammunition with multi-spectral output CYALUME TECHNOLOGIES, INC. (US) 2024-03-26 US claimed
EP-4288476-A1 HFCO-CONTAINING ISOCYANATE-REACTIVE COMPOSITIONS, POLYURETHANE FOAMS FORMED THEREFROM, AND COMPOSITE ARTICLES THAT INCLUDE SUCH FOAMS Covestro LLC (US) 2023-12-13 EP claimed
WO-2023140886-A2 PROJECTILE PAYLOAD FOR TRAINING AMMUNITION WITH MULTI-SPECTRAL OUTPUT CYALUME TECHNOLOGIES, INC. (US) 2023-07-27 WO claimed
US-20230194226-A1 Projectile payload for training ammunition with multi-spectral output PNC BANK, NATIONAL ASSOCIATION, AS ADMINISTRATIVE AGENT 2023-06-22 US claimed
WO-2022169578-A1 HFCO-CONTAINING ISOCYANATE-REACTIVE COMPOSITIONS, POLYURETHANE FOAMS FORMED THEREFROM, AND COMPOSITE ARTICLES THAT INCLUDE SUCH FOAMS COVESTRO LLC (US) 2022-08-11 WO claimed
CN-1174955-C 3-amino-2-benzyl-1-phenyl-propane derivs. 2004-11-10 CN claimed
US-6653508-B2 Use treating various medical conditions, including pain GRUENENTHAL GMBH (DE) 2003-11-25 US claimed
US-20020161262-A1 3-Amino-2-benzyl-1-phenylpropane derivatives GRUENTENTHAL GMBH (DE) 2002-10-31 US claimed
CN-1373745-A 3-amino-2-benzyl-1-phenyl-propane derivs. GREULENTHAL GMBH (DE) 2002-10-09 CN claimed
EP-0752984-B1 PROCESS FOR THE PREPARATION OF CYCLOHEXYL-AZETIDINONES GLAXO WELLCOME SPA (IT) 1999-05-19 EP claimed
US-5817806-A Process for the preparation of cyclohexyl-azetidinones GLAXO WELLCOME SPA (IT) 1998-10-06 US claimed
EP-0752984-A1 PROCESS FOR THE PREPARATION OF CYCLOHEXYL-AZETIDINONES GLAXO WELLCOME S.p.A. (IT) 1997-01-15 EP claimed
WO-1995026333-A1 PROCESS FOR THE PREPARATION OF CYCLOHEXYL-AZETIDINONES GLAXO WELLCOME S.P.A. (IT) 1995-10-05 WO claimed
EP-0383089-B1 Cold curing reactive resin blend and its use BAYER AG (DE) 1994-04-06 EP claimed
US-5084544-A Reaction of polyepoxides and polyisocyanates to form polyurethanes BAYER AKTIENGESELLSCHAFT (DE) 1992-01-28 US claimed
EP-0383089-A2 Cold curing reactive resin blend and its use BAYER AG (DE) 1990-08-22 EP claimed
US-20250263530-A1 HFCO-CONTAINING ISOCYANATE-REACTIVE COMPOSITIONS, POLYURETHANE FOAMS FORMED THEREFROM, AND COMPOSITE ARTICLES INCLUDING SUCH FOAMS COVESTRO LLC 2025-08-21 US disclosed
EP-0206621-A1 Process for disproportionating silanes MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-12-30 EP 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-20020161262-A1 3-Amino-2-benzyl-1-phenylpropane derivatives PYGL, CYP11B2, GOT2 EPHX1 2645/4885TAAR1 3043/4885SLC6A2 690/4885

“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.