SCHEMBL234734

SCHEMBL234734

Fc1ccccc1N1CCNCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 3/20 0.62
HTR7 P34969 5/20 0.59
HTR1A P08908 7/20 0.58
SLC6A2 P23975 3/20 0.58
SLC6A4 P31645 3/20 0.58
SLC6A3 Q01959 2/20 0.57
HTR6 P50406 4/20 0.56
HTR3A P46098 4/20 0.56
HTR2A P28223 2/20 0.56
HTR5A P47898 2/20 0.56
HTR3E A5X5Y0 2/20 0.56
HTR3B O95264 2/20 0.56
HTR3D Q70Z44 2/20 0.56
HTR3C Q8WXA8 2/20 0.56
SIGMAR1 Q99720 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
NCF1 P14598 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56

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
SCHEMBL2414711 1.00 ADRB1 (0.62) ADRB1HTR7HTR1ASLC6A2SLC6A4
SCHEMBL29448034 1.00 ADRB1 (0.62) ADRB1HTR7HTR1ASLC6A2SLC6A4
Hydrochloric Acid SCHEMBL1239646 0.98 ADRB1 (0.60) ADRB1HTR7HTR1ASLC6A2SLC6A4
Hydrochloric Acid SCHEMBL29882262 0.98 ADRB1 (0.60) ADRB1HTR7HTR1ASLC6A2SLC6A4
SCHEMBL19187683 0.93 ADRB1 (0.55) ADRB1HTR7HTR1ASLC6A2SLC6A4
SCHEMBL15834279 0.84 ADRB1 (0.75) ADRB1HTR7HTR1ASLC6A2SLC6A4
SCHEMBL30839785 0.84 HTR1A (0.58) ADRB1HTR7HTR1ASLC6A2SLC6A4
SCHEMBL1441614 0.84 HTR1A (0.58) ADRB1HTR7HTR1ASLC6A2SLC6A4
Hydrochloric Acid SCHEMBL7241183 0.82 HTR1A (0.57) ADRB1HTR7HTR1ASLC6A2SLC6A4
SCHEMBL5370353 0.81 HTR6 (0.64) ADRB1HTR7HTR1ASLC6A2SLC6A4

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 1516 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118396080-A Distributed machine learning privacy protection method and system based on homomorphic encryption and signature algorithm 东南大学 2024-07-26 CN claimed
CN-116227738-B Method and system for predicting traffic interval of power grid customer service 广东电网有限责任公司 2023-12-08 CN claimed
CN-116680816-B Method, device, equipment and medium for correcting hole-making normal vector of aircraft component 成都飞机工业(集团)有限责任公司 2023-11-10 CN claimed
CN-116680816-A Method, device, equipment and medium for correcting hole-making normal vector of aircraft component 成都飞机工业(集团)有限责任公司 2023-09-01 CN claimed
US-20230150924-A1 NOVEL COMPOUND HAVING CANCER METASTASIS INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR INHIBITING CANCER METASTASIS AND INVASION OR TREATING COLORECTAL CANCER, COMPRISING COMPOUND CELLGENTEK CO., LTD. (KR) 2023-05-18 US claimed
CN-108473451-B Synthesis of 1- [2- (2, 4-dimethyl-phenylsulfanyl) -phenyl ] piperazine H.隆德贝克有限公司 2022-07-15 CN claimed
EP-4019495-A1 NOVEL COMPOUND HAVING CANCER METASTASIS INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR INHIBITING CANCER METASTASIS AND INVASION OR TREATING COLORECTAL CANCER, COMPRISING COMPOUND Cellgentek Co., Ltd (KR) 2022-06-29 EP claimed
CN-108690216-B Base material for liquid filter 帝人株式会社 2022-06-21 CN claimed
CN-113343419-B Design and evaluation method for line width of mutual injection locking light source 成都飞机工业(集团)有限责任公司 2022-06-14 CN claimed
CN-113103211-B Feedforward control method and device for parallel processing robot 清华大学 2022-06-14 CN claimed
US-20050113574-A1 Methods and compositions comprising diamines as new anti-tubercular therapeutics SEQUELLA, INC. 2005-05-26 US claimed
WO-2005034857-A2 METHODS AND COMPOSITIONS COMPRISING DIAMINES AS NEW ANTI-TUBERCULAR THERAPEUTICS SEQUELLA, INC. (US) 2005-04-21 WO claimed
CN-1186332-C Novel thyroid receptor ligands and method II KAROBIO AB (SE) 2005-01-26 CN claimed
EP-1204677-A2 CYCLOHEXAPEPTIDE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS A PHARMACEUTICAL Aventis Pharma Deutschland GmbH (DE) 2002-05-15 EP claimed
CN-1337953-A Novel thyroid receptor ligands and method II KAROBIO AB (SE) 2002-02-27 CN claimed
WO-2001007468-A2 NOVEL CYCLOHEXAPEPTIDE COMPOUNDS, PROCESSES FOR THEIR PRODUCTION AND THEIR USE AS A PHARMACEUTICAL AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-02-01 WO claimed
EP-0254623-B1 AMINOALKYLTHIO TRIAZOLOPYRIDINE OR TRIAZOLOQUINOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, MEDICAMENTS CONTAINING THEM, PARTICULARLY USEFUL AS ANTALGICS LABORATOIRES UPSA (FR) 1993-06-09 EP claimed
EP-0539180-A1 Antiviral agents SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1993-04-28 EP claimed
US-4868299-A Antibacterially active pyrido-benzothiazine derivatives with long-term action MEDIOLANUM FARMACEUTICI SRL (IT) 1989-09-19 US claimed
EP-0254623-A1 Aminoalkylthio triazolopyridine or triazoloquinoline derivatives, process for their preparation, medicaments containing them, particularly useful as antalgics LABORATOIRES UPSA (FR) 1988-01-27 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 (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-20050113574-A1 Methods and compositions comprising diamines as new anti-tubercular therapeutics C5, DDC, SAT1 ADRB1 2139/4885HTR7 4571/4885HTR1A 4448/4885
US-20230150924-A1 NOVEL COMPOUND HAVING CANCER METASTASIS INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR INHIBITING CANCER METASTASIS AND INVASION OR TREATING COLORECTAL CANCER, COMPRISING COMPOUND KNTC1, MED1, LEF1 ADRB1 2085/4885HTR7 4360/4885HTR1A 4359/4885

“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.