SCHEMBL4913199

SCHEMBL4913199

Fc1cccc(-c2cc(F)cc(N3CCNCC3)c2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 12/20 0.66
HTR1A P08908 11/20 0.66
HTR6 P50406 5/20 0.57
HTR2A P28223 4/20 0.57
HTR1D P28221 3/20 0.57
HTR2B P41595 3/20 0.57
HTR2C P28335 3/20 0.57
HTR1B P28222 1/20 0.57
HTR3A P46098 3/20 0.52
DRD2 P14416 1/20 0.51
KDR P35968 1/20 0.46
HTR3E A5X5Y0 2/20 0.45
HTR3B O95264 2/20 0.45
HTR3D Q70Z44 2/20 0.45
HTR3C Q8WXA8 2/20 0.45
SIGMAR1 Q99720 2/20 0.45
ALDH1A1 P00352 2/20 0.45
SLC6A4 P31645 3/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A3 Q01959 1/20 0.45

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
SCHEMBL4908691 0.89 HTR7 (0.66) HTR7HTR1AHTR6HTR2AHTR1D
SCHEMBL4914478 0.88 HTR7 (0.59) HTR7HTR1AHTR6HTR2AHTR1D
SCHEMBL4907297 0.86 HTR2C (0.63) HTR7HTR1AHTR6HTR2AHTR1D
SCHEMBL4913526 0.85 ADRB1 (0.63) HTR7HTR1AHTR6HTR2AHTR1D
SCHEMBL4912823 0.84 HTR7 (0.69) HTR7HTR1AHTR6HTR2AHTR1D
SCHEMBL315894 0.83 HTR7 (0.68) HTR7HTR1AHTR6HTR2AHTR1D
Hydrochloric Acid SCHEMBL9743614 0.82 HTR7 (0.66) HTR7HTR1AHTR6HTR2AHTR1D
Hydrochloric Acid SCHEMBL11556656 0.82 HTR7 (0.66) HTR7HTR1AHTR6HTR2AHTR1D
Bromide SCHEMBL6774182 0.82 HTR7 (0.66) HTR7HTR1AHTR6HTR2AHTR1D
Bromide SCHEMBL27376788 0.80 HTR7 (0.64) HTR7HTR1AHTR6HTR2AHTR1D

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080119477-A1 N-Biaryl and N-Arylheteroaryl Piperazine Derivatives as Modulators of the 5Ht2c Receptor Useful For the Treatment of Disorders Related Thereto ARENA PHARMACEUTICALS, INC. 2008-05-22 US claimed
US-20210052600-A1 THERAPEUTIC AGENTS FOR STRESS URINARY INCONTINENCE AND INCOTINENCE OF FECES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-02-25 US disclosed
EP-3733204-A1 THERAPEUTIC AGENT FOR STRESS URINARY INCONTINENCE AND FECAL INCONTINENCE Takeda Pharmaceutical Company Limited (JP) 2020-11-04 EP disclosed
US-20080119477-A1 N-Biaryl and N-Arylheteroaryl Piperazine Derivatives as Modulators of the 5Ht2c Receptor Useful For the Treatment of Disorders Related Thereto ARENA PHARMACEUTICALS, INC. 2008-05-22 US disclosed
US-20080119477-A1 N-Biaryl and N-Arylheteroaryl Piperazine Derivatives as Modulators of the 5Ht2c Receptor Useful For the Treatment of Disorders Related Thereto ARENA PHARMACEUTICALS, INC. 2008-05-22 US disclosed
US-20080119477-A1 N-Biaryl and N-Arylheteroaryl Piperazine Derivatives as Modulators of the 5Ht2c Receptor Useful For the Treatment of Disorders Related Thereto ARENA PHARMACEUTICALS, INC. 2008-05-22 US disclosed
EP-1828156-A2 N-BIARYL AND N-ARYLHETEROARYL PIPERAZINE DERIVATIVES AS MODULATORS OF THE 5HT2C RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2007-09-05 EP disclosed
WO-2006065600-A2 N-BIARYL AND N-ARYLHETEROARYL PIPERAZINE DERIVATIVES AS MODULATORS OF THE 5HT2C RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2006-06-22 WO 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 (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-20080119477-A1 N-Biaryl and N-Arylheteroaryl Piperazine Derivatives as Modulators of the 5Ht2c Receptor Useful For the Treatment of Disorders Related Thereto HTR2C, HTR2A, HTR5A HTR7 10/4885HTR1A 9/4885HTR6 17/4885

“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.