SCHEMBL5632192

SCHEMBL5632192

CC1CN(C)CCN1c1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
HTR2C P28335 2/20 0.47
HTR2A P28223 1/20 0.47
HTR2B P41595 1/20 0.47
SIGMAR1 Q99720 2/20 0.46
HTR3E A5X5Y0 1/20 0.46
HTR3B O95264 1/20 0.46
HTR1D P28221 1/20 0.46
HTR3A P46098 1/20 0.46
HTR3D Q70Z44 1/20 0.46
HTR3C Q8WXA8 1/20 0.46
MAPT P10636 2/20 0.44
THRB P10828 1/20 0.44
TRPV4 Q9HBA0 1/20 0.44
NOTUM Q6P988 1/20 0.44
HTR7 P34969 1/20 0.44
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALOX5 P09917 1/20 0.42
PTGS1 P23219 1/20 0.42

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
SCHEMBL5632737 1.00 ALDH1A1 (0.50) ALDH1A1HTR2CHTR2AHTR2BSIGMAR1
SCHEMBL5632187 1.00 ALDH1A1 (0.50) ALDH1A1HTR2CHTR2AHTR2BSIGMAR1
Trifluoroacetic Acid SCHEMBL5631307 0.91 NOTUM (0.49) ALDH1A1HTR2CHTR2AHTR2BTRPV4
Trifluoroacetic Acid SCHEMBL5632724 0.91 NOTUM (0.49) ALDH1A1HTR2CHTR2AHTR2BTRPV4
SCHEMBL5632213 0.85 TRPV4 (0.45) ALDH1A1HTR2CHTR2AHTR2BSIGMAR1
SCHEMBL5632306 0.85 TRPV4 (0.45) ALDH1A1HTR2CHTR2AHTR2BSIGMAR1
SCHEMBL5632218 0.85 TRPV4 (0.45) ALDH1A1HTR2CHTR2AHTR2BSIGMAR1
SCHEMBL5633089 0.82 TRPV4 (0.53) HTR2CHTR2AHTR2BTRPV4NOTUM
SCHEMBL5630781 0.82 TRPV4 (0.53) HTR2CHTR2AHTR2BTRPV4NOTUM
SCHEMBL5630774 0.82 TRPV4 (0.53) HTR2CHTR2AHTR2BTRPV4NOTUM

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-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases ARENA PHARMACEUTICALS, INC. 2007-08-02 US claimed
CN-1809545-A N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5HT2c ARENA PHARM INC (US) 2006-07-26 CN 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-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases ARENA PHARMACEUTICALS, INC. 2007-08-02 US disclosed
CN-1809545-A N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5HT2c ARENA PHARM INC (US) 2006-07-26 CN disclosed
EP-1644347-A1 N-PHENYL-PIPERAZINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT sb 2C /sb RECEPTOR ASSOCIATED DISEASES Arena Pharmaceuticals, Inc. (US) 2006-04-12 EP disclosed
WO-2005016902-A1 N-PHENYL-PIPERAZINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT2C RECEPTOR ASSOCIATED DISEASES ARENA PHARMACEUTICALS, INC. (US) 2005-02-24 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-20070179155-A1 N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5ht2c receptor associated diseases HTR2C, HTR2A, HTR5A ALDH1A1 881/4885HTR2C 1/4885HTR2A 2/4885

“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.