SCHEMBL379449

SCHEMBL379449

COc1cccc(N2CCNCC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 5/20 1.00
HTR1A P08908 6/20 0.67
HTR2C P28335 3/20 0.67
HTR1D P28221 1/20 0.67
HTR1B P28222 1/20 0.67
HTR3A P46098 3/20 0.66
HTR3E A5X5Y0 2/20 0.66
HTR3B O95264 2/20 0.66
HTR3D Q70Z44 2/20 0.66
HTR3C Q8WXA8 2/20 0.66
SIGMAR1 Q99720 2/20 0.66
HTR7 P34969 6/20 0.63
NPC1 O15118 1/20 0.59
MAPT P10636 1/20 0.59
HTR2A P28223 3/20 0.59
HTR6 P50406 3/20 0.59
HTR2B P41595 2/20 0.59
TP53 P04637 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59

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
SCHEMBL7838014 1.00 ADRB1 (1.00) ADRB1HTR1AHTR2CHTR1DHTR1B
Bromide SCHEMBL27617608 0.98 ADRB1 (0.97) ADRB1HTR1AHTR2CHTR1DHTR1B
Piperazine SCHEMBL28092166 0.98 ADRB1 (0.97) ADRB1HTR1AHTR2CHTR1DHTR1B
Hydrochloric Acid SCHEMBL1706127 0.98 ADRB1 (0.97) ADRB1HTR1AHTR2CHTR1DHTR1B
SCHEMBL5669070 0.98 ADRB1 (0.97) ADRB1HTR1AHTR2CHTR1DHTR1B
Bromide SCHEMBL4875933 0.98 ADRB1 (0.97) ADRB1HTR1AHTR2CHTR1DHTR1B
Hydrochloric Acid SCHEMBL1024982 0.98 ADRB1 (0.97) ADRB1HTR1AHTR2CHTR1DHTR1B
Hydrochloric Acid SCHEMBL7757785 0.98 ADRB1 (0.97) ADRB1HTR1AHTR2CHTR1DHTR1B
SCHEMBL4526848 0.94 ADRB1 (0.88) ADRB1HTR1AHTR2CHTR1DHTR1B
SCHEMBL11074672 0.87 ADRB1 (0.76) ADRB1NPC1MAPTCYP1A2CYP3A4

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 1072 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025133248-A1 DIASTEREOMERIC AMINOALCOHOL AND AMINOETHER SALTS OF 2-[(4R,S)-8-FLUORO-2-[4-(3-METHOXYPHENYL)PIPERAZIN-1-YL]-3-[2-METHOXY-5-(TRIFLUOROMETHYL)PHENYL]-3,4-DIHYDROQUINAZOLIN-4-YL]ACETIC ACID AND THEIR USE FOR ENANTIOMERIC SEPARATION AIC246 AG & CO. KG (DE) 2025-06-26 WO claimed
CN-119798172-A Preparation method of Leitemivir key intermediate dihydroquinazoline ester 仁合益康集团有限公司 2025-04-11 CN claimed
CN-119330912-A Fluorescent probe low-dimensional organic-inorganic hybrid halide material for nitrobenzene with high moisture stability and high quantum yield fluorescence 济宁学院 2025-01-21 CN claimed
CN-118373778-A Preparation method of letromycin 湖北广济医药科技有限公司 2024-07-23 CN claimed
CN-115850192-A Process for preparing 3,4-dihydroquinazoline derivatives 南京正大天晴制药有限公司 2023-03-28 CN claimed
CN-112831206-B Inorganic oxide dispersion with controllable water content and preparation method thereof 凯斯科技股份有限公司 2022-12-30 CN claimed
CN-111879767-B Color development test method of piperazine novel mental active substance 福建警察学院 2022-05-03 CN claimed
CN-111795963-B Method for chromogenic detection of piperazine novel psychotropic active substances 福建警察学院 2022-05-03 CN claimed
CN-110452130-B Obovatol Mannich base derivative and preparation method and application thereof 山西农业大学 2022-03-01 CN claimed
CN-110437191-B 13-amino xanthatin derivative and preparation method and application thereof 山西农业大学 2021-05-04 CN claimed
EP-1831206-A2 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS AND COMBINATORIAL BENZIMIDAZOLE LIBRARY OSI Pharmaceuticals, Inc. (US) 2007-09-12 EP claimed
WO-2006133822-A1 METHOD FOR PRODUCING DIHYDROQUINAZOLINES BAYER HEALTHCARE AG (DE) 2006-12-21 WO claimed
WO-2006060381-A2 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS AND COMBINATORIAL BENZIMIDAZOLE LIBRARY OSI PHARMACEUTICALS, INC. (US) 2006-06-08 WO claimed
US-20060116402-A1 N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. 2006-06-01 US claimed
CN-1662516-A N, N-disubstituted diazocycloalkanes RECORDATI CHEM PHARM (IE) 2005-08-31 CN claimed
CN-1538951-A Omega-aminoalkylamides of R-2-aryl-propionic acids as inhibitors of chemotaxis of polymorphonucleate and mononucleate cells ��ķ�ɷ����޹�˾ 2004-10-20 CN claimed
EP-1077973-A2 BENZOFURAN DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND A PROCESS FOR THE PREPARATION OF THE ACTIVE INGREDIENT EGIS GYOGYSZERGYAR RT. (HU) 2001-02-28 EP claimed
WO-1999058527-A2 BENZOFURAN DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND A PROCESS FOR THE PREPARATION OF THE ACTIVE INGREDIENT EGIS Gyógyszergyár Rt. (HU) 1999-11-18 WO claimed
EP-0445811-B1 Nitrogen-containing heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-06-14 EP claimed
EP-0539180-A1 Antiviral agents SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1993-04-28 EP 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-20060116402-A1 N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole library KIT, CHUK, TNNI3K ADRB1 3656/4885HTR1A 4095/4885HTR2C 3698/4885

“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.