SCHEMBL218290

SCHEMBL218290

CCc1ccnc(CC)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.61
NOS1 P29475 1/20 0.61
NOS2 P35228 1/20 0.61
CYP1A2 P05177 2/20 0.52
POLB P06746 1/20 0.52
SREBF1 P36956 1/20 0.40
SREBF2 Q12772 1/20 0.40
TRPA1 O75762 1/20 0.39
PRKCI P41743 1/20 0.39
MAP4K4 O95819 1/20 0.38
CYP2A6 P11509 1/20 0.38
CDC7 O00311 1/20 0.38
DBF4 Q9UBU7 1/20 0.38
TYMS P04818 1/20 0.38
SMYD3 Q9H7B4 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
RIOK2 Q9BVS4 1/20 0.36

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
SCHEMBL11563922 0.98 NOS3 (0.59) NOS3NOS1NOS2CYP1A2POLB
Dimethylamine SCHEMBL7744073 0.93 NOS3 (0.55) NOS3NOS1NOS2CYP1A2POLB
SCHEMBL13337725 0.84 NOS3 (0.55) NOS3NOS1NOS2CYP1A2POLB
SCHEMBL14470239 0.84 NOS3 (0.55) NOS3NOS1NOS2CYP1A2POLB
SCHEMBL16775566 0.84 CYP1A2 (0.47) NOS3NOS1NOS2CYP1A2POLB
SCHEMBL15200880 0.84 NOS3 (0.61) NOS3NOS1NOS2CYP1A2POLB
SCHEMBL1654460 0.84 LOXL2 (0.55) NOS3NOS1NOS2CYP1A2POLB
SCHEMBL10066451 0.84 NOS3 (0.55) NOS3NOS1NOS2CYP1A2POLB
SCHEMBL5115940 0.84 NOS3 (0.55) NOS3NOS1NOS2CYP1A2POLB
SCHEMBL2935815 0.84 RECQL (0.55) NOS3NOS1NOS2CYP1A2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110862473-A Catalyst for olefin polymerization reaction, preparation method and composite catalyst 中国石油化工股份有限公司 2020-03-06 CN claimed
US-9796800-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2017-10-24 US claimed
US-20160108153-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORPORATION (JP) 2016-04-21 US claimed
US-9249244-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2016-02-02 US claimed
EP-2619233-A1 PROCESS FOR PRODUCING POLYDIENES Bridgestone Corporation (JP) 2013-07-31 EP claimed
WO-2012040026-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORPORATION (JP) 2012-03-29 WO claimed
US-4150993-A AMINEBORANE COMPOUND KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1979-04-24 US claimed
US-12559458-B2 Co-crystals or salts of psilocin and methods of treatment therewith Reset Pharmaceuticals, Inc. (US) 2026-02-24 US disclosed
EP-4486448-A1 CO-CRYSTALS OR SALTS COMPRISING PSILOCIN Reset Pharmaceuticals, Inc. (US) 2025-01-08 EP disclosed
US-20240383849-A1 CO-CRYSTAL OR SALT Reset Pharmaceuticals, Inc. 2024-11-21 US disclosed
CN-118871423-A Co-crystals or salts comprising xylometacin 雷塞特制药股份有限公司 2024-10-29 CN disclosed
US-12060328-B2 Co-crystals or salts of psilocybin and methods of treatment therewith Reset Pharmaceuticals, Inc. (US) 2024-08-13 US disclosed
WO-2023220137-A1 PYRAZINE DERIVATIVES AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2023-11-16 WO disclosed
US-4740320-A REACTION OF NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPONENT, KETONE OR ALDEHYDE, AMINE OR POLYAMINE THE DOW CHEMICAL COMPANY (US) 1988-04-26 US disclosed
US-4725373-A CORROSION RESISTANCE FOR METAL TOOLS AND EQUIPMENT USED IN OIL AND GAS WELLS THE DOW CHEMICAL COMPANY (US) 1988-02-16 US disclosed
US-4724003-A Asphalt compositions containing anti-stripping additives prepared from hydrocarbyl substituted nitrogen-containing aromatic heterocyclic compounds, aldehydes or ketones and amines THE DOW CHEMICAL COMPANY (US) 1988-02-09 US disclosed
US-4676834-A Novel compositions prepared from methyl substituted nitrogen-containing aromatic heterocyclic compounds and an aldehyde or ketone THE DOW CHEMICAL COMPANY (US) 1987-06-30 US disclosed
US-4157262-A Intensification of photographic silver images by physical development and improvement in physical developer solution for use therein FUJI PHOTO FILM CO., LTD. (JP) 1979-06-05 US disclosed
US-4150993-A AMINEBORANE COMPOUND KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1979-04-24 US disclosed
US-4042602-A Synthesis of dideoxyzearalane and related compounds IMC CHEMICAL GROUP, INC. (US) 1977-08-16 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-20240383849-A1 CO-CRYSTAL OR SALT SLC6A3, SLC6A2, OPRK1 NOS3 2442/4885NOS1 2402/4885NOS2 2632/4885
US-12060328-B2 Co-crystals or salts of psilocybin and methods of treatment therewith SLC6A3, SLC6A2, HTR2B NOS3 1608/4885NOS1 1813/4885NOS2 1594/4885
US-12559458-B2 Co-crystals or salts of psilocin and methods of treatment therewith SLC6A2, SLC6A4, SLC6A3 NOS3 3195/4885NOS1 3445/4885NOS2 3189/4885

“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.