SCHEMBL4931077

SCHEMBL4931077

COc1cc2c(cc1Cc1ccccc1)C(C)CNCC2

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 16/20 0.60
▸ HTR2A P28223 15/20 0.60
▸ HTR2B P41595 14/20 0.57
▸ DRD1 P21728 3/20 0.50
▸ DRD5 P21918 3/20 0.50
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 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
Hydrochloric Acid SCHEMBL4933341 0.99 HTR2C (0.58) HTR2CHTR2AHTR2BDRD1DRD5
Hydrochloric Acid SCHEMBL4933355 0.99 HTR2C (0.58) HTR2CHTR2AHTR2BDRD1DRD5
Hydrochloric Acid SCHEMBL4933363 0.99 HTR2C (0.58) HTR2CHTR2AHTR2BDRD1DRD5
SCHEMBL14282073 0.82 HTR2C (0.56) HTR2CHTR2AHTR2BDRD1DRD5
SCHEMBL4936396 0.82 HTR2C (0.56) HTR2CHTR2AHTR2BDRD1DRD5
SCHEMBL4939238 0.82 HTR2C (0.56) HTR2CHTR2AHTR2B
Hydrochloric Acid SCHEMBL4933108 0.81 HTR2C (0.54) HTR2CHTR2AHTR2B
Hydrochloric Acid SCHEMBL4933105 0.81 HTR2C (0.54) HTR2CHTR2AHTR2B
Hydrochloric Acid SCHEMBL4933106 0.81 HTR2C (0.54) HTR2CHTR2AHTR2B
Hydrochloric Acid SCHEMBL4929651 0.81 HTR2C (0.54) HTR2CHTR2AHTR2BDRD1DRD5

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-20080009478-A1 Benzazepine Derivatives and Methods of Prophylaxis or Treatment of 5Ht2c Receptor Associated Diseases ARENA PHARMACEUTICALS, INC. (US) 2008-01-10 — — US claimed
WO-2005042491-A1 BENZAZEPINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT2C RECEPTOR ASSOCIATED DISEASES ARENA PHARMACEUTICALS, INC. (US) 2005-05-12 — — WO 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-20080009478-A1 Benzazepine Derivatives and Methods of Prophylaxis or Treatment of 5Ht2c Receptor Associated Diseases ARENA PHARMACEUTICALS, INC. (US) 2008-01-10 — — US disclosed
US-20080009478-A1 Benzazepine Derivatives and Methods of Prophylaxis or Treatment of 5Ht2c Receptor Associated Diseases ARENA PHARMACEUTICALS, INC. (US) 2008-01-10 — — US disclosed
US-20080009478-A1 Benzazepine Derivatives and Methods of Prophylaxis or Treatment of 5Ht2c Receptor Associated Diseases ARENA PHARMACEUTICALS, INC. (US) 2008-01-10 — — US disclosed
WO-2005042491-A1 BENZAZEPINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT2C RECEPTOR ASSOCIATED DISEASES ARENA PHARMACEUTICALS, INC. (US) 2005-05-12 — — 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-20080009478-A1 Benzazepine Derivatives and Methods of Prophylaxis or Treatment of 5Ht2c Receptor Associated Diseases HTR2C, HTR2A, HTR2B HTR2C 1/4885HTR2A 2/4885HTR2B 3/4885

“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.

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