SCHEMBL2291506

SCHEMBL2291506

CNc1cccc(CN)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.50
PNMT P11086 1/20 0.48
ENPP2 Q13822 1/20 0.48
LOXL2 Q9Y4K0 3/20 0.48
NOS1 P29475 5/20 0.44
NOS2 P35228 5/20 0.44
NOS3 P29474 3/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CYP3A4 P08684 1/20 0.43
NFKB1 P19838 1/20 0.43
TSHR P16473 1/20 0.42
BPTF Q12830 1/20 0.42
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
CFD P00746 1/20 0.41
APP P05067 1/20 0.41
PRMT6 Q96LA8 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
SCHEMBL30583565 1.00 HTR6 (0.50) HTR6PNMTENPP2LOXL2NOS1
Hydrochloric Acid SCHEMBL27831019 0.98 HTR6 (0.49) HTR6PNMTENPP2LOXL2NOS1
Hydrochloric Acid SCHEMBL31662788 0.98 HTR6 (0.49) HTR6PNMTENPP2LOXL2NOS1
SCHEMBL28000087 0.91 HTR6 (0.44) HTR6PNMTENPP2LOXL2NOS1
Hydrochloric Acid SCHEMBL28000099 0.86 HTR6 (0.44) HTR6PNMTENPP2LOXL2NOS1
SCHEMBL18905641 0.84 TSHR (0.48) HTR6CYP3A4TSHRAPP
SCHEMBL20027769 0.83 HTR6 (0.47) HTR6PNMTENPP2LOXL2NOS1
SCHEMBL15511268 0.83 TAAR1 (0.57) HTR6LOXL2NOS1SMN1; SMN2
Tert-Butyl Formate SCHEMBL28788527 0.82 HTR6 (0.41) HTR6PNMTENPP2LOXL2BPTF
SCHEMBL27903338 0.82 HTR6 (0.53) HTR6PNMTENPP2LOXL2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117186959-A M45 methanol gasoline and preparation method thereof 金玖洲新能源有限公司 2023-12-08 CN claimed
US-9321756-B2 Azole compounds as PIM inhibitors AMGEN INC. (US) 2016-04-26 US claimed
US-20140187553-A1 Azole Compounds as PIM Inhibitors AMGEM INC. (US) 2014-07-03 US claimed
CN-103865595-A M20 methanol gasoline power performance improver GANSU SANGTIAN CLEANING ENERGY DEV CO LTD 2014-06-18 CN claimed
EP-2688886-A1 AZOLE COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2014-01-29 EP claimed
WO-2012129338-A1 AZOLE COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-09-27 WO claimed
US-20260035513-A1 RESIN COMPOSITION, REINFORCED COMPOSITE MATERIAL, SHAPED PRODUCT, AND METHOD OF RECOVERING REINFORCING FIBER FROM REINFORCED COMPOSITE MATERIAL ASAHI KASEI KABUSHIKI KAISHA (JP) 2026-02-05 US disclosed
US-20250325687-A1 CONJUGATE COMPRISING TOLL-LIKE RECEPTOR AGONIST MABSOFT THERAPEUTICS SHANGHAI CO LTD (CN) 2025-10-23 US disclosed
EP-4578892-A1 RESIN COMPOSITION, COMPOSITE REINFORCING MATERIAL, MOLDED BODY, AND METHOD FOR RECOVERING REINFORCING FIBERS FROM COMPOSITE REINFORCING MATERIAL Asahi Kasei Kabushiki Kaisha (JP) 2025-07-02 EP disclosed
WO-2025127092-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2025-06-19 WO disclosed
US-20250197353-A1 METHOD OF FORMING BOND BY COUPLING REACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-06-19 US disclosed
CN-120051729-A Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element 日产化学株式会社 2025-05-27 CN disclosed
CN-119912343-A Preparation method of N-substituent-m-aminobenzylamine 苏州敬业医药化工有限公司 2025-05-02 CN disclosed
CN-1278251-A Novel carboxylic acid derivatives which carry amide side chains, prodn. of same, and use as endothelin receptor antagonists BASF AG (DE) 2000-12-27 CN disclosed
EP-0882715-A1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-12-09 EP disclosed
EP-0559310-B1 Ink compositions ZENECA LTD (GB) 1996-04-03 EP disclosed
US-5383960-A Ink jet printing inks ZENECA LIMITED (GB) 1995-01-24 US disclosed
EP-0372729-B1 Reactive dyes ZENECA LTD (GB) 1995-01-18 EP disclosed
EP-0559310-A1 Ink compositions ZENECA LIMITED (GB) 1993-09-08 EP disclosed
EP-0372729-A1 Reactive dyes ZENECA LIMITED (GB) 1990-06-13 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 (4 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-20140187553-A1 Azole Compounds as PIM Inhibitors PIM1, PIM3, PIM2 HTR6 4688/4885PNMT 901/4885ENPP2 4276/4885
US-20250325687-A1 CONJUGATE COMPRISING TOLL-LIKE RECEPTOR AGONIST TLR3, TLR7, TLR8 HTR6 689/4885PNMT 2752/4885ENPP2 236/4885
US-20260035513-A1 RESIN COMPOSITION, REINFORCED COMPOSITE MATERIAL, SHAPED PRODUCT, AND METHOD OF RECOVERING REINFORCING FIBER FROM REINFORCED COMPOSITE MATERIAL TAF1, TAF1L, TAF9 HTR6 2574/4885PNMT 3402/4885ENPP2 4280/4885
US-20250197353-A1 METHOD OF FORMING BOND BY COUPLING REACTION CBR1, CBR3, NOX4 HTR6 2859/4885PNMT 2890/4885ENPP2 1702/4885

“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.