SCHEMBL5630378

SCHEMBL5630378

C[C@@H]1CNCCN1c1ccc(F)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 1/20 0.46
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
SLC6A3 Q01959 1/20 0.45
ADAMTS5 Q9UNA0 13/20 0.43
MMP14 P50281 9/20 0.42
MMP2 P08253 8/20 0.42
MMP13 P45452 3/20 0.42
HTR2C P28335 4/20 0.41
HTR2B P41595 3/20 0.41
HTR2A P28223 2/20 0.40
ADRB1 P08588 1/20 0.40

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
SCHEMBL5630383 1.00 RAD52 (0.46) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
SCHEMBL5632581 1.00 RAD52 (0.46) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
Hydrochloric Acid SCHEMBL28350085 0.99 RAD52 (0.48) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
Hydrochloric Acid SCHEMBL5632260 0.99 RAD52 (0.48) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
Hydrochloric Acid SCHEMBL5631596 0.99 RAD52 (0.48) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
Hydrochloric Acid SCHEMBL5631590 0.99 RAD52 (0.48) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
Hydrochloric Acid SCHEMBL17871204 0.99 RAD52 (0.48) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
SCHEMBL5630986 0.89 RAD52 (0.46) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
SCHEMBL5633042 0.89 RAD52 (0.46) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5
SCHEMBL30609666 0.89 RAD52 (0.46) RAD52SLC6A2SLC6A4SLC6A3ADAMTS5

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 9 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
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
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
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 RAD52 1733/4885SLC6A2 60/4885SLC6A4 56/4885

“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.