SCHEMBL681571

SCHEMBL681571

CCCCc1cccnc1

nearest known ligand 0.89

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.89
L3MBTL1 Q9Y468 1/20 0.89
CYP2A6 P11509 1/20 0.66
HRH1 P35367 2/20 0.61
CHRNA7 P36544 2/20 0.59
TBXAS1 P24557 6/20 0.56
ALDH1A1 P00352 1/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HRH4 Q9H3N8 1/20 0.54
HRH3 Q9Y5N1 1/20 0.54
CHRNB2 P17787 1/20 0.53
CHRNA4 P43681 1/20 0.53

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 SCHEMBL29205003 0.98 TDP1 (0.85) TDP1L3MBTL1CYP2A6HRH1CHRNA7
Bromide SCHEMBL28337045 0.98 TDP1 (0.85) TDP1L3MBTL1CYP2A6HRH1CHRNA7
SCHEMBL28193002 0.98 TDP1 (0.85) TDP1L3MBTL1CYP2A6HRH1CHRNA7
Fluoride SCHEMBL29204969 0.98 TDP1 (0.85) TDP1L3MBTL1CYP2A6HRH1CHRNA7
SCHEMBL18301254 0.98 TDP1 (0.85) TDP1L3MBTL1CYP2A6HRH1CHRNA7
Dimethylamine SCHEMBL7749424 0.94 TDP1 (0.79) TDP1L3MBTL1CYP2A6HRH1CHRNA7
SCHEMBL135032 0.94 TDP1 (1.00) TDP1L3MBTL1CYP2A6HRH1CHRNA7
SCHEMBL30705204 0.93 TDP1 (0.77) TDP1L3MBTL1CYP2A6HRH1CHRNA7
SCHEMBL25381172 0.92 TDP1 (0.96) TDP1L3MBTL1CYP2A6HRH1CHRNA7
SCHEMBL25381701 0.92 TDP1 (0.96) TDP1L3MBTL1CYP2A6HRH1CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118834490-A Photo-crosslinkable perfluorinated ion membrane and preparation method thereof 上海交通大学 2024-10-25 CN claimed
CN-118130691-A Method for detecting characteristic components of typical aroma in main stream smoke of cigarettes 上海烟草集团有限责任公司 2024-06-04 CN claimed
CN-114799613-B Copper paste and preparation method and application thereof 深圳先进电子材料国际创新研究院 2023-11-07 CN claimed
CN-112996771-B Polyisocyanate composition, coating composition and coated substrate 旭化成株式会社 2023-08-01 CN claimed
EP-4205565-A1 TOBACCO FILLING MATERIAL AND TOBACCO PRODUCT Japan Tobacco Inc. (JP) 2023-07-05 EP claimed
US-20230173472-A1 PROCESS AND CATALYST FOR THE PREPARATION OF ETHYLENE BP P.L.C. (GB) 2023-06-08 US claimed
EP-4149675-A1 PROCESS AND CATALYST FOR THE PREPARATION OF ETHYLENE BP P.L.C. (GB) 2023-03-22 EP claimed
CN-115666191-A Method for improving stability of perovskite solar cell device 深港产学研基地(北京大学香港科技大学深圳研修院) 2023-01-31 CN claimed
CN-115485065-A Process and catalyst for the preparation of ethylene 英国石油有限公司 2022-12-16 CN claimed
CN-114799613-A Copper soldering paste and preparation method and application thereof 深圳先进电子材料国际创新研究院 2022-07-29 CN claimed
EP-0998261-A1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES CONTAINING A 3-AMINOPYRIDINE AZO DERIVATIVE AND DYEING METHOD USING SAID COMPOSITION L'OREAL (FR) 2000-05-10 EP claimed
EP-0994692-A1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES CONTAINING A 3-AMINOPYRIDINE AZO DERIVATIVE AND DYEING METHOD USING SAID COMPOSITION L'OREAL (FR) 2000-04-26 EP claimed
WO-1999048466-A1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES CONTAINING A 3-AMINOPYRIDINE AZO DERIVATIVE AND DYEING METHOD USING SAID COMPOSITION L'OREAL (FR) 1999-09-30 WO claimed
WO-1999048465-A1 OXIDATION DYEING COMPOSITION FOR KERATINOUS FIBRES CONTAINING A 3-AMINOPYRIDINE AZO DERIVATIVE AND DYEING METHOD USING SAID COMPOSITION L'OREAL (FR) 1999-09-30 WO claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
EP-0098684-A2 Modified chichibabin reaction, and novel pyridine derivatives REILLY INDUSTRIES, INC. (US) 1984-01-18 EP claimed
US-4386209-A Chichibabin reaction REILLY TAR & CHEMICAL CORPORATION (US) 1983-05-31 US claimed
US-4124386-A Color diffusion transfer receiving layer comprising polymeric quaternary n-heterocyclic mordant FUJI PHOTO FILM CO., LTD. (JP) 1978-11-07 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-20230173472-A1 PROCESS AND CATALYST FOR THE PREPARATION OF ETHYLENE FOS, JUN, EEF1D TDP1 4716/4885L3MBTL1 3831/4885CYP2A6 1250/4885

“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.