SCHEMBL1760718

SCHEMBL1760718

CCC(CC)c1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
CYP17A1 P05093 3/20 0.44
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
CYP19A1 P11511 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
GAA P10253 1/20 0.38
LMNA P02545 2/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL14444744 0.90 CYP17A1 (0.46) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL15958590 0.86 SLC6A2 (0.41) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL9059286 0.84 ESR1 (0.55) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL22163128 0.84 CYP3A4 (0.39) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL14168821 0.83 CYP17A1 (0.38) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL12663389 0.83 TRPA1 (0.38) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL6287468 0.83 CYP17A1 (0.38) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL21755116 0.83 NR1I2 (0.46) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL13069818 0.83 CYP17A1 (0.38) CYP3A4CYP2C19CYP17A1SLC6A2SLC6A4
SCHEMBL19003601 0.81 NR1I2 (0.53) CYP3A4CYP2C19CYP17A1SLC6A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3564227-B1 METHOD FOR PRODUCING GLYCERIC ACID ESTER DERIVATIVES KAO CORP (JP) 2022-02-23 EP claimed
EP-1172878-B1 Non-aqueous electrolytic solution and secondary battery containing same MITSUBISHI CHEM CORP (JP) 2011-06-22 EP claimed
US-6767671-B2 STABILITY; HEAT RESISTANCE MITSUBISHI CHEMICAL CORPORATION (JP) 2004-07-27 US claimed
US-20020025477-A1 Non-aqueous electrolytic solution and secondary battery containing same MITSUBISHI CHEMICAL CORPORATION (JP) 2002-02-28 US claimed
EP-1172878-A2 Non-aqueous electrolytic solution and secondary battery containing same MITSUBISHI CHEMICAL CORPORATION (JP) 2002-01-16 EP claimed
US-4447643-A CONCENTRATION IN RECTIFYING COLUMN, AND DISTILLATION NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1984-05-08 US claimed
US-4409406-A Process for recovering ethanol from dilute aqueous solutions employing liquid extraction media NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1983-10-11 US claimed
US-4346241-A Process for recovering ethanol from dilute aqueous solutions employing liquid extraction media NATIONAL DISTILLERS & CHEMICAL CORP. (US) 1982-08-24 US claimed
US-4177349-A BY-PRODUCT INHIBITION REILLY TAR & CHEMICAL CORPORATION (US) 1979-12-04 US claimed
US-20260131307-A1 Bi-Metallic Pillared-Layered Coordination Polymers for Carbon Dioxide Removal UNIV OF PUERTO RICO (US) 2026-05-14 US disclosed
US-12540073-B2 Heterogeneous hydrogen-catalyst solid fuel reaction mixture and reactor BRILLIANT LIGHT POWER, INC. (US) 2026-02-03 US disclosed
US-12515195-B2 Bi-metallic pillared-layered coordination polymers for carbon dioxide removal UNIVERSITY OF PUERTO RICO 2026-01-06 US disclosed
EP-3878838-B1 POLYISOCYANATE COMPOSITION, COATING COMPOSITION AND COATED SUBSTRATE ASAHI CHEMICAL IND (JP) 2025-07-23 EP disclosed
US-20240042415-A1 Bi-Metallic Pillared-Layered Coordination Polymers for Carbon Dioxide Removal UNIVERSITY OF PUERTO RICO (PR) 2024-02-08 US disclosed
EP-0273724-B1 ACID GAS SCRUBBING BY COMPOSITE SOLVENT-SWOLLEN MEMBRANES BEND RESEARCH, INC. (US) 1992-06-17 EP disclosed
EP-0336535-A1 Gas separation by composite solvent-swollen membranes BEND RESEARCH, INC. (US) 1989-10-11 EP disclosed
US-4824443-A HIGHLY POLAR SOLVENT BEND RESEARCH, INC. (US) 1989-04-25 US disclosed
EP-0273724-A2 Acid gas scrubbing by composite solvent-swollen membranes BEND RESEARCH, INC. (US) 1988-07-06 EP disclosed
US-4737166-A SEPARATION OF HYDROGEN SULFIDE AND CARBON DIOXIDE FROM HYDROGEN, CARBON MONOXIDE AND HYDROCARBON GASES; SUPPORTED POLYMER BEND RESEARCH, INC. (US) 1988-04-12 US disclosed
US-4286085-A PROMOTERS INTERFACIAL POLYMERIZATION GENERAL ELECTRIC COMPANY (US) 1981-08-25 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 (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-20260131307-A1 Bi-Metallic Pillared-Layered Coordination Polymers for Carbon Dioxide Removal MAP2K4, MAP2K1, MAP2K2 CYP3A4 2440/4885CYP2C19 2224/4885CYP17A1 3512/4885
US-12540073-B2 Heterogeneous hydrogen-catalyst solid fuel reaction mixture and reactor SCO2, SOD1, HAO2 CYP3A4 2348/4885CYP2C19 4037/4885CYP17A1 3465/4885

“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.