SCHEMBL2045230

SCHEMBL2045230

c1ccc(N2CCCN2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.50
SIGMAR1 Q99720 3/20 0.50
HTR3E A5X5Y0 1/20 0.50
HTR3B O95264 1/20 0.50
ADRB1 P08588 1/20 0.50
HTR3A P46098 1/20 0.50
HTR3D Q70Z44 1/20 0.50
HTR3C Q8WXA8 1/20 0.50
G6PD P11413 2/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
USP2 O75604 3/20 0.42
CYP2D6 P10635 3/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP1A2 P05177 1/20 0.42
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL11884832 0.93 ALOX5 (0.48) ALOX5SIGMAR1HTR3EHTR3BADRB1
Acetic Acid SCHEMBL10948107 0.89 ALOX5 (0.46) ALOX5SIGMAR1HTR3EHTR3BADRB1
SCHEMBL11401370 0.88 ALOX5 (0.38) ALOX5SIGMAR1HTR3EHTR3BADRB1
SCHEMBL9347292 0.88 ALOX5 (0.50) ALOX5SIGMAR1HTR3EHTR3BADRB1
SCHEMBL24527382 0.78 KDM4E (0.40) HTR3AALDH1A1TSHRHTR1AHTR7
SCHEMBL28290847 0.78 ADRB2 (0.53) CYP2D6ALDH1A1CYP3A4CYP1A2TSHR
SCHEMBL28030097 0.78 ADRB1 (0.53) ALOX5ADRB1HTR3AALDH1A1HTR1A
SCHEMBL28030091 0.78 HTR3A (0.53) ALOX5SIGMAR1HTR3EHTR3BADRB1
SCHEMBL28236696 0.78 CHRNB2 (0.38) ALOX5ADRB1USP2L3MBTL1CHRNB2
SCHEMBL4722355 0.78 ALOX5 (0.32) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021111448-A1 COMPOSITIONS FOR PATTERNING A METAL ON A SUBSTRATE AND METHODS OF USING SAME SCODIX LTD. (IL) 2021-06-10 WO claimed
US-4662905-A REACTION PRODUCT OF COPPER SALT AND AN IMIDAZOLE, PYRAZOLE, TRIAZOLE, OR TETRAZOLE Itaru Todoriki, Director of Agency of Industrial Science and Technology (JP) 1987-05-05 US claimed
US-4440696-A FROM A PHENOL AND PHOSPHORUS TRIHALIDE, AMINE OR AMIDE CATALYST CIBA-GEIGY CORPORATION (US) 1984-04-03 US claimed
US-4390606-A Color-forming para-sulfonamidodiphenylamine dye precursor and sulfonimide dye in photographic material and process EASTMAN KODAK COMPANY (US) 1983-06-28 US claimed
JP-6332100-A None JP disclosed
JP-62212651-A None JP disclosed
JP-5117239-A None JP disclosed
US-11807646-B2 4-hydroxypiperidine derivatives and their use as inhibitors of ubiquitin specific protease 19 (USP19) ALMAC DISCOVERY LIMITED (GB) 2023-11-07 US disclosed
EP-3746432-B1 4-HYDROXYPIPERIDINE DERIVATIVES AND THEIR USE AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) ALMAC DISCOVERY LTD (GB) 2022-12-14 EP disclosed
US-20220033397-A1 PHARMACEUTICAL COMPOUNDS AND THEIR USE AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) ALMAC DISCOVERY LTD (GB) 2022-02-03 US disclosed
EP-3890829-A1 PHARMACEUTICAL COMPOUNDS AND THEIR USE AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) Almac Discovery Limited (GB) 2021-10-13 EP disclosed
CN-113365696-A Pharmaceutical compounds and their use as inhibitors of ubiquitin-specific protease 19(USP19) 阿尔麦克探索有限公司 2021-09-07 CN disclosed
US-RE30199-E Oxidation hair dyes based upon tetraaminopyrimidine developers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 1980-01-29 US disclosed
US-4168168-A SILVER HALIDE EMULSIONS, SILVER IMAGE DIFFUSION OF SILVER OR COPPER IONS INTO GLASS SUPPORT FUJI PHOTO FILM CO., LTD. (JP) 1979-09-18 US disclosed
EP-0000757-A1 Process for the preparation of triarylphosphites CIBA-GEIGY AG (CH) 1979-02-21 EP disclosed
US-RE29498-E PEROXIDASE ENZYME SYSTEM Istituto Sieroterapico e Vaccinogeno Toscano "SCLAVO", S.p.A. (IT) 1977-12-20 US disclosed
US-4045458-A FRIEDEL-CRAFTS CATALYSTS KANZAKI PAPER MANUFACTURING CO., LTD. (JA) 1977-08-30 US disclosed
US-4003699-A Oxidation hair dyes based upon tetraaminopyrimidine developers HENKEL & CIE G.M.B.H. (DT) 1977-01-18 US disclosed
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 US disclosed
US-3930671-A Color former and pressure-sensitive copying paper FUJI PHOTO FILM CO., LTD. (JA) 1976-01-06 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-20220033397-A1 PHARMACEUTICAL COMPOUNDS AND THEIR USE AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) USP19, USP16, USP18 ALOX5 3521/4885SIGMAR1 4703/4885HTR3E 3932/4885
US-11807646-B2 4-hydroxypiperidine derivatives and their use as inhibitors of ubiquitin specific protease 19 (USP19) USP19, USP16, USP18 ALOX5 3847/4885SIGMAR1 4079/4885HTR3E 2813/4885

“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.