SCHEMBL3868206

SCHEMBL3868206

CC1=Cc2cc(F)ccc2C1CC(=O)Cl

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
SLC6A4 P31645 1/20 0.30
HTR2B P41595 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL11661901 0.81 ACHE (0.32)
SCHEMBL11850956 0.79
SCHEMBL11661015 0.77 KCNE1 (0.32)
SCHEMBL11853875 0.69 POLB (0.33)
SCHEMBL1452157 0.66 KDM1A (0.31) HTR2AHTR2CHTR2B
SCHEMBL1452653 0.66 KDM1A (0.31) HTR2AHTR2CHTR2B
SCHEMBL11806271 0.66 GAA (0.32)
SCHEMBL11857719 0.66 MEN1 (0.31)
SCHEMBL11664241 0.65 ACHE (0.32)
SCHEMBL11658164 0.65 ACHE (0.32)

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1435962-A4 TREATMENT OF TYPE I DIABETES CELL PATHWAYS INC (US) 2009-04-15 EP disclosed
US-20060252762-A1 Methods for treatment of multiple sclerosis WHITEHEAD CLARK M 2006-11-09 US disclosed
US-20060100210-A1 Methods for treatment of scleroderma WHITEHEAD CLARK M 2006-05-11 US disclosed
US-6906064-B2 Method for treating a patient with neoplasia using Iressa OSI PHARMACEUTICALS, INC. 2005-06-14 US disclosed
EP-1435961-A4 TREATMENT FOR LUPUS ERYTHEMATOSUS CELL PATHWAYS INC (US) 2005-04-20 EP disclosed
EP-1435940-A4 TREATMENT OF SCLERODERMA CELL PATHWAYS INC (US) 2005-04-20 EP disclosed
EP-1435962-A2 TREATMENT OF TYPE I DIABETES Cell Pathways, Inc. (US) 2004-07-14 EP disclosed
EP-1435782-A1 TREATMENT FOR CYSTIC FIBROSIS Cell Pathways, Inc. (US) 2004-07-14 EP disclosed
EP-1435961-A2 TREATMENT FOR LUPUS ERYTHEMATOSUS Cell Pathways, Inc. (US) 2004-07-14 EP disclosed
EP-1435940-A1 TREATMENT OF SCLERODERMA Cell Pathways, Inc. (US) 2004-07-14 EP disclosed
US-20030009033-A1 Substituted condensation products of N-benzyl-3-indenylacent amides with heterocyclic aldehydes for neoplasia OSI PHARMACEUTICALS, INC. 2003-01-09 US disclosed
US-6479493-B1 INHIBITING PHOSPHODIESTERASE 2 IN THE DISEASED TISSUE, WITHOUT SUBSTANTIALLY INHIBITING CYCLOOXYGENASES I AND II, THEREBY CAUSING MACROPHAGE APOPTOSIS CELL PATHWAYS, INC. 2002-11-12 US disclosed
US-6465494-B1 PHOSPHODIESTERASE 2 AND 5 INHIBITORS; DOES NOT SUBSTANTIALLY INHIBIT COX I OR II; INDUCING APOPTOSIS IN PULMONARY MACROPHAGES THAT GENERATE LUNG DAMAGING METABOLITES AND LEUKOTRIENE B4 CELL PATHWAYS, INC. 2002-10-15 US disclosed
WO-2002067936-A1 METHODS FOR TREATMENT OF INFLAMMATORY BOWEL DISEASE CELL PATHWAYS, INC. (US) 2002-09-06 WO disclosed
US-6426349-B1 ADMINISTERING (Z)-5-FLUORO-2-METHYL-(4-PYRIDYLIDENE)-3-(N-BENZYL) INDENYLACETAMIDE HYDROCHLORIDE; REGULATING APOPTOSIS CELL PATHWAY AND THE UNIVERSITY OF ARIZONA 2002-07-30 US disclosed
US-6166053-A Substituted condensation products of N-benzyl-3-idenylacetamides with heterocyclic aldehydes for neoplasia CELL PATHWAYS, INC. (US) 2000-12-26 US disclosed
EP-1044187-A1 N-BENZYL-3-INDENYLACETAMIDES DERIVATIVES FOR TREATING NEOPLASIA OSI Pharmaceuticals, Inc. (US) 2000-10-18 EP disclosed
US-6066634-A PHOSPHODIESTERASE INHIBITOR CELL PATHWAYS, INC. (US) 2000-05-23 US disclosed
US-5948779-A APOPTOSIS; ANTICANCER AGENT CELL PATHWAYS, INC. (US) 1999-09-07 US disclosed
WO-1999031065-A1 N-BENZYL-3-INDENYLACETAMIDES DERIVATIVES FOR TREATING NEOPLASIA CELL PATHWAYS, INC. (US) 1999-06-24 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 (3 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-20030009033-A1 Substituted condensation products of N-benzyl-3-indenylacent amides with heterocyclic aldehydes for neoplasia ACIN1, AOX1, CCAR2 HTR2A 3503/4885HTR2C 3046/4885SLC6A4 4266/4885
US-20060100210-A1 Methods for treatment of scleroderma SSB, TST, ETF1 HTR2A 4160/4885HTR2C 4067/4885SLC6A4 3878/4885
US-20060252762-A1 Methods for treatment of multiple sclerosis MYT1, PMP22, OTC HTR2A 3963/4885HTR2C 3751/4885SLC6A4 2882/4885

“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.