SCHEMBL166615

SCHEMBL166615

c1ccc(-c2cnccn2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 2/20 0.52
▸ PIM1 P11309 1/20 0.51
▸ CYP19A1 P11511 2/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ PIM2 Q9P1W9 1/20 0.50
▸ METAP2 P50579 1/20 0.50
▸ ASIC3 Q9UHC3 1/20 0.47
▸ KDR P35968 1/20 0.46
▸ CYP11B1 P15538 3/20 0.46
▸ CYP11B2 P19099 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ NOTUM Q6P988 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ RAB9A P51151 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
SCHEMBL29904375 1.00 CYP2A6 (0.52) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
Ammonia Solution, Strong SCHEMBL27498840 0.98 CYP2A6 (0.50) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL4552312 0.98 CYP2A6 (0.50) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL6061020 0.98 CYP2A6 (0.50) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
SCHEMBL13457927 0.96 CYP19A1 (0.51) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
Pyridine SCHEMBL28875197 0.94 CYP2A6 (0.57) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
SCHEMBL9974946 0.88 PIM1 (0.48) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
SCHEMBL11541937 0.87 CYP2D6 (0.60) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
SCHEMBL9974997 0.87 PIM1 (0.47) CYP2A6PIM1CYP19A1CYP2D6CYP2C9
SCHEMBL21322286 0.86 PIM2 (0.55) CYP2A6PIM1CYP19A1PIM2METAP2

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 1844 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999817-B1 Bismaleimide-thiol-epoxy polymer compositions, and methods of making and using the same HRL LABORATORIES, LLC (US) 2024-06-04 — — US claimed
US-11980462-B2 Salivary biosensors and biofuel cells THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-05-14 — — US claimed
CN-114644582-B Preparation method of phenyl dithiourea compound 中原工学院 2024-03-29 — — CN claimed
US-20230212355-A1 METHOD FOR PREPARING POLYHYDROXYURETHANE, POLYHYDROXYURETHANE PREPARED USING THE METHOD AND PRESSURE-SENSITIVE ADHESIVE COMPRISING THE POLYHYDROXYURETHANE KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-07-06 — — US claimed
CN-115943190-A Multifunctional material for temporary bonding 布鲁尔科技公司 2023-04-07 — — CN claimed
EP-2651991-B2 USE OF A POLYMER OF ACRYLIC ACID AS DISPERSANT IN MINERAL PROCESSING BASF SE (DE) 2022-12-21 — — EP claimed
CN-109152363-B Molecules having pesticidal utility, and intermediates, compositions and methods related to these molecules 美国陶氏益农公司 2021-10-15 — — CN claimed
US-10950815-B2 Light-emitting element comprising stacked light-emitting layers, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2021-03-16 — — US claimed
US-20200384451-A1 PHOSPHINE FREE COBALT BASED CATALYST, PROCESS FOR PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2020-12-10 — — US claimed
US-20200367793-A1 SALIVARY BIOSENSORS AND BIOFUEL CELLS NATIONAL SCIENCE FOUNDATION 2020-11-26 — — US claimed
EP-0069286-B1 PROCESS FOR THE PRODUCTION OF POSSIBLY CELLULAR POLYURETHANE POLYUREA MOULDED ARTICLES, AND ALKYL- SUBSTITUTED PHENYLENE DIAMINES FOR THAT PURPOSE BASF Aktiengesellschaft (DE) 1985-09-18 — — EP claimed
EP-0004872-B1 SOLUTION FOR THE ETCHING OF SILICON WAFERS HAVING A WELL-DEFINED ETCHING RATE AND METHOD RESULTING THEREFROM International Business Machines Corporation (US) 1981-10-28 — — EP claimed
EP-0009677-B1 QUATERNARY SOLUTION FOR THE CHEMICAL ETCHING OF SILICON AND METHOD FOR ETCHING USING SUCH A SOLUTION International Business Machines Corporation (US) 1981-10-28 — — EP claimed
EP-0009677-A1 Quaternary solution for the chemical etching of silicon and method for etching using such a solution International Business Machines Corporation (US) 1980-04-16 — — EP claimed
US-4190585-A 2,3-DIHYDRO-2,5-FURAN DICARBOXYLIC ACID, PHENYL HYDRAZINE, SULFURIC ACID LONZA LTD. (CH) 1980-02-26 — — US claimed
US-4187140-A ETHYLENEDIAMINE, PYROCATECHOL AND A DIAZINE INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1980-02-05 — — US claimed
EP-0004872-A2 Solution for the etching of silicon wafers having a well-defined etching rate and method resulting therefrom International Business Machines Corporation (US) 1979-10-31 — — EP claimed
US-4155866-A Method of controlling silicon wafer etching rates-utilizing a diazine catalyzed etchant INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1979-05-22 — — US claimed
US-4021368-A Process of treating mycelia of fungi for retention of metals CESKOSLOVENSKA KOMISE PRO ATOMOVOU ENERGII PRAHA (CS) 1977-05-03 — — US claimed
US-3959182-A OXIDATION; OXIDES OR SALTS OF MOLYBDENUM AND VANADIUM ROHM AND HAAS COMPANY (US) 1976-05-25 — — US claimed

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-20200384451-A1 PHOSPHINE FREE COBALT BASED CATALYST, PROCESS FOR PREPARATION AND USE THEREOF CPNE4, PPOX, PDCD5 CYP2A6 1850/4885PIM1 80/4885CYP19A1 389/4885

“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.

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