SCHEMBL2504209

SCHEMBL2504209

CNCc1ccc(CNC)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.68
CYP3A4 P08684 1/20 0.68
MAPT P10636 1/20 0.68
LOXL2 Q9Y4K0 1/20 0.67
NCF1 P14598 2/20 0.56
NOS3 P29474 1/20 0.54
NOS1 P29475 1/20 0.54
NOS2 P35228 1/20 0.54
ADRB2 P07550 1/20 0.50
HTR7 P34969 1/20 0.42
MMP8 P22894 1/20 0.41
TAAR1 Q96RJ0 3/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
PRMT6 Q96LA8 1/20 0.40
PARP1 P09874 1/20 0.40
PRKACA P17612 1/20 0.40
PRKACG P22612 1/20 0.40
PRKACB P22694 1/20 0.40

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
Hydrochloric Acid SCHEMBL30925271 0.97 KDM4E (0.74) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL13184538 0.91 KDM4E (0.59) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL296509 0.88 MAPT (0.56) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL2848915 0.88 MAPT (0.56) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL24036381 0.86 KDM4E (0.54) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL155051 0.86 TAAR1 (0.60) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL15004592 0.86 KDM4E (0.54) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL17123634 0.86 KDM4E (0.54) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL20630777 0.86 KDM4E (0.54) KDM4ECYP3A4MAPTLOXL2NCF1
SCHEMBL680484 0.86 CYP3A4 (0.57) KDM4ECYP3A4MAPTLOXL2NCF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112321985-B MMA (methyl methacrylate) polymer material and preparation method thereof 天津市公路工程总公司 2022-09-30 CN claimed
CN-111548592-B MMA polymer thin-layer color antiskid paving material and preparation method and construction method thereof 天津佰思特交通科技股份有限公司 2022-05-17 CN claimed
CN-112321985-A MMA (methyl methacrylate) polymer material and preparation method thereof 天津市公路工程总公司 2021-02-05 CN claimed
CN-111548592-A MMA polymer thin-layer color antiskid paving material and preparation method and construction method thereof 天津佰思特交通科技股份有限公司 2020-08-18 CN claimed
US-20090215922-A1 Dental root canal filling cones KLEE JOACHIM E 2009-08-27 US claimed
EP-1911433-A1 Dental obturator point Dentsply DeTrey GmbH (DE) 2008-04-16 EP claimed
US-20050267232-A1 Dental root canal filling cones KLEE JOACHIM E 2005-12-01 US claimed
EP-1416901-B1 DENTAL ROOT CANAL FILLING CONES DENTSPLY INT INC (US) 2005-10-26 EP claimed
US-20030045604-A1 Dental root canal filling cones KLEE JOACHIM E (DE) 2003-03-06 US claimed
US-6362115-B1 DISSOCIATING 1,4-BIS(FORMATOMETHYL)BENZENE OR 1,4-BIS(N-METHYLAMINOMETHYL) BENZENE, CONDENSING P-XYLYLENE TO FORM A POLYMERIZED THIN POLYMER OR COPOLYMER LAYER; LOW DIELECTRIC CONSTANTS; SEMICONDUCTORS APPLIED MATERIALS, INC. 2002-03-26 US claimed
EP-0763016-A1 COMPOSITIONS AND METHODS FOR TREATING MAST-CELL MEDIATED CONDITIONS ARRIS PHARMACEUTICAL CORPORATION (US) 1997-03-19 EP claimed
WO-1995032945-A1 COMPOSITIONS AND METHODS FOR TREATING MAST-CELL MEDIATED CONDITIONS ARRIS PHARMACEUTICAL CORPORATION (US) 1995-12-07 WO claimed
EP-4601786-A1 SORBENT COMPOSITIONS, SYSTEMS, AND METHODS General Electric Technology GmbH (CH) 2025-08-20 EP disclosed
CN-120202061-A Sorbent compositions, systems, and methods 通用电气技术有限公司 2025-06-24 CN disclosed
EP-3623398-B1 RESIN COMPOSITION COMPRISING A MODIFIED BLOCK COPOLYMER AND METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER ASAHI CHEMICAL IND (JP) 2024-08-28 EP disclosed
US-12034115-B2 Solid electrolyte composition, sheet for all-solid state secondary battery, electrode sheet for all-solid state secondary battery, and all-solid state secondary battery FUJIFILM CORPORATION (JP) 2024-07-09 US disclosed
US-5387368-A A mixture of an aryl diamine, a transition metal compound and a phosphorus compound; prevents oxidation and decay of organic MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-02-07 US disclosed
EP-0542512-A1 Oxygen-scavenging composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1993-05-19 EP disclosed
US-4140658-A Cyanamides of secondary amines as epoxy curing agents CIBA-GEIGY CORPORATION (US) 1979-02-20 US disclosed
US-3946014-A Process for preparing certain 1,3,4-dioxazol-2-ones and products ATLANTIC RICHFIELD COMPANY (US) 1976-03-23 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 (3 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-20090215922-A1 Dental root canal filling cones DRD1, DRD4, DRD2 KDM4E 2266/4885CYP3A4 3140/4885MAPT 442/4885
US-20050267232-A1 Dental root canal filling cones DRD1, DRD4, DRD2 KDM4E 2266/4885CYP3A4 3140/4885MAPT 442/4885
US-20030045604-A1 Dental root canal filling cones DRD1, DRD4, DRD2 KDM4E 2266/4885CYP3A4 3140/4885MAPT 442/4885

“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.