SCHEMBL5532469

SCHEMBL5532469

c1ccc2c(c1)OCC1CNCCN21

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 19/20 0.54
HTR2B P41595 14/20 0.54
HTR2A P28223 9/20 0.44
DRD2 P14416 1/20 0.44

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 SCHEMBL6425272 0.98 HTR2C (0.52) HTR2CHTR2BHTR2ADRD2
SCHEMBL2018190 0.85 HTR2C (0.58) HTR2CHTR2BHTR2A
SCHEMBL693081 0.85 HTR2C (0.58) HTR2CHTR2BHTR2A
SCHEMBL692326 0.85 HTR2C (0.58) HTR2CHTR2BHTR2A
SCHEMBL11558985 0.84 SMN1; SMN2 (0.39) HTR2CHTR2BHTR2A
SCHEMBL23913128 0.80 HTR2C (0.49) HTR2CHTR2BHTR2A
SCHEMBL22459930 0.80 HTR2C (0.42) HTR2CHTR2BHTR2A
SCHEMBL21469131 0.80 HTR2C (0.42) HTR2CHTR2BHTR2A
SCHEMBL22652086 0.80 HTR2C (0.42) HTR2CHTR2BHTR2A
SCHEMBL8857971 0.80 HTR2C (0.57) HTR2CHTR2BHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765829-A1 TRICYCLIC COMPOUNDS AND THEIR USE AS MGLUR1 ANTAGONISTS SCHERING CORPORATION (US) 2007-03-28 EP claimed
WO-2006002051-A1 TRICYCLIC COMPOUNDS AND THEIR USE AS MGLUR1 ANTAGONISTS SCHERING CORPORATION (US) 2006-01-05 WO claimed
WO-1994020497-A1 PYRROLO-PYRIDINE DERIVATIVES MERCK SHARP & DOHME LIMITED (GB) 1994-09-15 WO claimed
EP-3553064-B1 COMPOUND CONTAINING TRICYCLIC HETEROARYL GROUP HANGZHOU INNOGATE PHARMA CO LTD (CN) 2023-06-07 EP disclosed
WO-2023088406-A1 FUSED IMIDE DERIVATIVE 正大天晴药业集团股份有限公司 2023-05-25 WO disclosed
US-20220204473-A1 COMPOUND AS IRAK INHIBITOR WUHAN CREATERNA SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2022-06-30 US disclosed
WO-2020188467-A1 CONDENSED TRICYCLIC COMPOUND USED AS KINASE INHIBITOR 杭州英创医药科技有限公司 2020-09-24 WO disclosed
EP-0746556-B1 TRICYCLIC COMPOUNDS HAVING AFFINITY FOR THE 5-HT1A RECEPTOR ORTHO PHARMA CORP (US) 2002-09-25 EP disclosed
US-6376488-B1 SPECIFIC ADRENORECEPTOR ANTAGONISTS FOR TREATING BENIGN PROSTATIC HYPERPLASIA, BLADDER OUTLET OBSTRUCTION, NEUROGENIC BLADDER, AND GYNECOLOGICAL SYNDROMES ABBOTT LABORATORIES 2002-04-23 US disclosed
WO-1994020497-A1 PYRROLO-PYRIDINE DERIVATIVES MERCK SHARP & DOHME LIMITED (GB) 1994-09-15 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-20220204473-A1 COMPOUND AS IRAK INHIBITOR IRAK1, IRAK3, IRAK2 HTR2C 4487/4885HTR2B 4027/4885HTR2A 4420/4885

“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.