SCHEMBL249732

SCHEMBL249732

N#Cc1cccc(N2CCNCC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 1.00
DRD3 P35462 2/20 1.00
ADRB1 P08588 4/20 0.59
HTR3E A5X5Y0 3/20 0.59
HTR3B O95264 3/20 0.59
HTR3A P46098 3/20 0.59
HTR3D Q70Z44 3/20 0.59
HTR3C Q8WXA8 3/20 0.59
SIGMAR1 Q99720 3/20 0.59
HTR1A P08908 3/20 0.59
HTR7 P34969 3/20 0.59
HTR2C P28335 3/20 0.59
THRB P10828 2/20 0.59
HTR6 P50406 2/20 0.59
TP53 P04637 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
HTR2A P28223 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
SCHEMBL30855584 1.00 DRD2 (1.00) DRD2DRD3ADRB1HTR3EHTR3B
Hydrochloric Acid SCHEMBL6494513 0.98 DRD2 (0.97) DRD2DRD3ADRB1HTR3EHTR3B
Hydrochloric Acid SCHEMBL6408589 0.98 DRD2 (0.97) DRD2DRD3ADRB1HTR3EHTR3B
Hydrochloric Acid SCHEMBL29882147 0.98 DRD2 (0.97) DRD2DRD3ADRB1HTR3EHTR3B
SCHEMBL20159295 0.94 DRD2 (0.88) DRD2DRD3ADRB1HTR3EHTR3B
Hydrochloric Acid SCHEMBL20141804 0.92 DRD2 (0.85) DRD2DRD3ADRB1HTR3EHTR3B
SCHEMBL8709443 0.92 DRD2 (0.85) DRD2DRD3ADRB1HTR3EHTR3B
SCHEMBL15800697 0.89 DRD2 (0.79) DRD2DRD3HTR1ATP53NOTUM
Trifluoroacetic Acid SCHEMBL3847590 0.86 DRD2 (0.74) DRD2DRD3ADRB1HTR3EHTR3B
SCHEMBL3537217 0.85 DRD2 (0.74) DRD2DRD3HTR1AALDH1A1NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118221620-A Benzamide phenylpiperazine radioactive compound and preparation method and application thereof 中国科学院高能物理研究所 2024-06-21 CN claimed
EP-3728234-B1 RADIOLABELED COMPOUNDS HOFFMANN LA ROCHE (CH) 2025-05-14 EP disclosed
CN-118745132-A Cedrus alcohol derivative and preparation method and application thereof 沈阳药科大学 2024-10-08 CN disclosed
CN-118221620-A Benzamide phenylpiperazine radioactive compound and preparation method and application thereof 中国科学院高能物理研究所 2024-06-21 CN disclosed
CN-111196806-B Guanidine derivative and application thereof 广东东阳光药业股份有限公司 2024-04-26 CN disclosed
CN-117751099-A Amide compound and application thereof 中国药科大学 2024-03-22 CN disclosed
US-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis GALAPAGOS NV (BE) 2023-08-08 US disclosed
US-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis GALAPAGOS NV (BE) 2023-08-08 US disclosed
US-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis GALAPAGOS NV (BE) 2023-08-08 US disclosed
WO-2023011596-A1 AMIDE COMPOUND AND USE THEREOF 中国药科大学 2023-02-09 WO disclosed
WO-2002068399-A1 ARYL CARBAMATE DERIVATIVES, PREPARATION AND USE THEREOF CEREP (FR) 2002-09-06 WO disclosed
US-20020045613-A1 1-aroyl-piperidinyl benzamidines AVENTIS PHARMACEUTICALS PRODUCTS INC. 2002-04-18 US disclosed
US-6355642-B1 PSYCHOLOGICAL DISORDERS AND BRAIN DISORDERS MEIJI SEIKA KAISHA, LTD. (JP) 2002-03-12 US disclosed
WO-2001081310-A1 1-AROYL-PIPERIDINYL BENZAMIDINES AVENTIS PHARMACEUTICALS INC. (US) 2001-11-01 WO disclosed
CN-1071754-C Pyrimidinylpyrazole derivative DAIICHI SEIYAKU CO (JP) 2001-09-26 CN disclosed
EP-0937715-A1 TETRAHYDROBENZINDOLE COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 1999-08-25 EP disclosed
WO-1999031096-A1 PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS SHAMAN PHARMACEUTICALS, INC. (US) 1999-06-24 WO disclosed
US-5852019-A Pyrimidinylpyrazole derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-12-22 US disclosed
CN-1166833-A pyrimidinyl pyrazole derivatives DAIICHI SEIYAKU CO (JP) 1997-12-03 CN disclosed
EP-0784055-A1 PYRIMIDINYLPYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-16 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 (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-20020045613-A1 1-aroyl-piperidinyl benzamidines TPSAB1, TPSB2, CMA1 DRD2 2633/4885DRD3 2646/4885ADRB1 898/4885
US-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis ADAMTS1, ADAMTS5, ADAMTS7 DRD2 4712/4885DRD3 4551/4885ADRB1 3478/4885

“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.