SCHEMBL9575282

SCHEMBL9575282

C(CCC1=NCCN1)CC1=NCCN1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 3/20 0.55
MAOA P21397 2/20 0.55
MAOB P27338 2/20 0.55
TAAR1 Q96RJ0 4/20 0.50
HTR1D P28221 5/20 0.47
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47
ADRA2A P08913 1/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 1/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
HTR1B P28222 1/20 0.42

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
SCHEMBL9575191 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
SCHEMBL11130718 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
SCHEMBL9575633 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
SCHEMBL11128132 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
SCHEMBL11132101 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
SCHEMBL11131504 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
Hydrochloric Acid SCHEMBL2419368 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
SCHEMBL989780 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
SCHEMBL11132599 0.97 NISCH (0.53) NISCHMAOAMAOBTAAR1HTR1D
SCHEMBL9575185 0.95 NISCH (0.55) NISCHMAOAMAOBTAAR1HTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4695613-A EPOXY RESIN, CYCLIC AMIDINE NEUTRALIZED OLIGOESTER HUELS AKTIENGESELLSCHAFT (DE) 1987-09-22 US claimed
EP-3087216-B1 BIS-IMIDAZOLINE COMPOUNDS AS CORROSION INHIBITORS AND PREPARATION THEREOF DOW GLOBAL TECHNOLOGIES LLC (US) 2018-10-10 EP disclosed
US-20160319442-A1 BIS-IMIDAZOLINE COMPOUNDS AS CORROSION INHIBITORS AND PREPARATION THEREOF DOW INTERNATIONAL TECHNOLOGY CORPORATION 2016-11-03 US disclosed
EP-3087216-A1 BIS-IMIDAZOLINE COMPOUNDS AS CORROSION INHIBITORS AND PREPARATION THEREOF Dow Global Technologies LLC (US) 2016-11-02 EP disclosed
WO-2015100031-A1 BIS-IMIDAZOLINE COMPOUNDS AS CORROSION INHIBITORS AND PREPARATION THEREOF DOW GLOBAL TECHNOLOGIES LLC (US) 2015-07-02 WO disclosed
US-7439011-B2 Photothermographic material FUJIFILM CORPORATION (JP) 2008-10-21 US disclosed
US-7419774-B2 Photothermographic material and method for processing the same FUJILFILM CORPORATION (JP) 2008-09-02 US disclosed
US-20070003887-A1 Photothermographic material RIKIO INOUE 2007-01-04 US disclosed
EP-0331507-B1 POLYVINYL CHLORIDE PLASTISOL COMPOSITION ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1993-05-19 EP disclosed
US-5210152-A Metal oxide vulcanization in the presence of amidine compounds BAYER AKTIENGESELLSCHAFT (DE) 1993-05-11 US disclosed
EP-0140324-B1 POLYARYLENE SULFIDES WITH REDUCED CORROSIVENESS BAYER AG (DE) 1989-06-21 EP disclosed
US-4695613-A EPOXY RESIN, CYCLIC AMIDINE NEUTRALIZED OLIGOESTER HUELS AKTIENGESELLSCHAFT (DE) 1987-09-22 US disclosed
EP-0175874-B1 CARBOXYL GROUP CONTAINING CURING AGENTS HÜLS AKTIENGESELLSCHAFT (DE) 1987-09-09 EP disclosed
EP-0111073-B1 PROCESS FOR THE PREPARATION OF 2-IMIDAZOLINES BASF Aktiengesellschaft (DE) 1987-02-25 EP disclosed
US-4609699-A AMINE STABILIZER BAYER AKTIENGESELLSCHAFT (DE) 1986-09-02 US disclosed
EP-0175874-A1 Carboxyl group containing curing agents HÜLS AKTIENGESELLSCHAFT (DE) 1986-04-02 EP disclosed
EP-0140324-A2 Polyarylene sulfides with reduced corrosiveness BAYER AG (DE) 1985-05-08 EP disclosed
US-4424313-A ORGANO-NITROGEN SALTS BAYER AKTIENGESELLSCHAFT (DE) 1984-01-03 US disclosed
US-4423204-A HEAT RESISTANCE MOLDING MATERIALS THE UPJOHN COMPANY (US) 1983-12-27 US disclosed
EP-0085913-A1 Reactive polymers containing carboxylic groups, process for their production and their use as curing agents in powder lacquers BAYER AG (DE) 1983-08-17 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-20160319442-A1 BIS-IMIDAZOLINE COMPOUNDS AS CORROSION INHIBITORS AND PREPARATION THEREOF SOD1, FHIT, TFPI NISCH 49/4885MAOA 15/4885MAOB 20/4885

“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.