SCHEMBL7159289

SCHEMBL7159289

CN1CCN(c2ccccc2-c2ccc(C(=O)NCc3ccc(Cl)cc3)o2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 9/20 0.60
KDM4E B2RXH2 8/20 0.60
ALDH1A1 P00352 7/20 0.60
MAPT P10636 5/20 0.60
HTT P42858 3/20 0.60
NPSR1 Q6W5P4 3/20 0.60
NPY1R P25929 1/20 0.60
POLB P06746 1/20 0.59
LMNA P02545 2/20 0.58
NPC1 O15118 3/20 0.51
NPBWR1 P48145 1/20 0.51
MCHR1 Q99705 1/20 0.51
RAB9A P51151 3/20 0.50
HSD17B10 Q99714 2/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAPKAPK2 P49137 1/20 0.50
TNIK Q9UKE5 1/20 0.50
DRD2 P14416 1/20 0.50
DRD3 P35462 1/20 0.50

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 SCHEMBL7158449 0.98 HPGD (0.58) HPGDKDM4EALDH1A1MAPTHTT
SCHEMBL7159726 0.90 ALDH1A1 (0.58) HPGDKDM4EALDH1A1MAPTHTT
SCHEMBL7158443 0.86 MAPKAPK2 (0.67) HPGDKDM4EALDH1A1MAPTHTT
SCHEMBL7587711 0.85 MAPT (0.49) HPGDKDM4EALDH1A1MAPTHTT
Hydrochloric Acid SCHEMBL7162377 0.84 MAPKAPK2 (0.65) HPGDKDM4EALDH1A1MAPTHTT
SCHEMBL7158128 0.83 NPBWR1 (0.48) HPGDKDM4EALDH1A1MAPTHTT
SCHEMBL7157877 0.80 NPBWR1 (0.49) HPGDKDM4EALDH1A1MAPTHTT
SCHEMBL7257324 0.80 NPBWR1 (0.49) HPGDKDM4EALDH1A1MAPTHTT
Hydrochloric Acid SCHEMBL7159814 0.79 NPBWR1 (0.48) HPGDKDM4EALDH1A1MAPTHTT
4-Chloroaniline SCHEMBL7249657 0.78 ALDH1A1 (0.54) HPGDKDM4EALDH1A1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030232841-A1 Heterocyclic carboxamides PFIZER INC 2003-12-18 US claimed
EP-0957099-B1 Heterocyclic carboxamides PFIZER PROD INC (US) 2002-11-20 EP claimed
US-20020049211-A1 Combination treatment for depression and anxiety SOBOLOV-JAYNES SUSAN BETH (US) 2002-04-25 US claimed
EP-1186318-A2 Combination, for treating depression and anxiety, containing a 5HT1d receptor antagonist and aCNS penetrant NK-1 receptor antagonist Pfizer Products Inc. (US) 2002-03-13 EP claimed
US-20020002168-A1 Heterocyclic carboxamides HOWARD HARRY R (US) 2002-01-03 US claimed
US-20010041705-A1 Heterocyclic carboxamides HOWARD HARRY R (US) 2001-11-15 US claimed
US-6277852-B1 FOR TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS PFIZER INC 2001-08-21 US claimed
EP-0957099-A2 Heterocyclic carboxamides Pfizer Products Inc. (US) 1999-11-17 EP claimed
JP-11322711-A None JP disclosed
WO-2020183011-A1 HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER INSTITUT CURIE (FR) 2020-09-17 WO disclosed
US-20030232841-A1 Heterocyclic carboxamides PFIZER INC 2003-12-18 US disclosed
US-6602874-B2 5-(2-(4-methylpiperazin-1-yl)-phenyl)- furan-2-carboxylic acid 4-chlorobenzylamide, for example; treating or preventing migraine, depression and other disorders for which a 5-HT1, agonist or antagonist is indicated PFIZER INC. 2003-08-05 US disclosed
US-6537995-B2 Selective serotonin receptor agonists and antagonists used to treat migraines, depression, anxiety and schizophrenia; sertraline PFIZER INC. 2003-03-25 US disclosed
EP-0957099-B1 Heterocyclic carboxamides PFIZER PROD INC (US) 2002-11-20 EP disclosed
EP-1186318-A2 Combination, for treating depression and anxiety, containing a 5HT1d receptor antagonist and aCNS penetrant NK-1 receptor antagonist Pfizer Products Inc. (US) 2002-03-13 EP disclosed
US-20020002168-A1 Heterocyclic carboxamides HOWARD HARRY R (US) 2002-01-03 US disclosed
US-20010041705-A1 Heterocyclic carboxamides HOWARD HARRY R (US) 2001-11-15 US disclosed
US-6277852-B1 FOR TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS PFIZER INC 2001-08-21 US disclosed
JP-H11322711-A HETEROCYCLIC CARBOXAMIDE PFIZER PROD INC 1999-11-24 JP disclosed
EP-0957099-A2 Heterocyclic carboxamides Pfizer Products Inc. (US) 1999-11-17 EP 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 (4 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-20020002168-A1 Heterocyclic carboxamides HTR1A, HTR1D, NPY1R HPGD 691/4885KDM4E 1133/4885ALDH1A1 1831/4885
US-20020049211-A1 Combination treatment for depression and anxiety HTR1A, HTR1D, HTR5A HPGD 1917/4885KDM4E 2074/4885ALDH1A1 534/4885
US-20030232841-A1 Heterocyclic carboxamides HTR1A, HTR1D, NPY1R HPGD 691/4885KDM4E 1133/4885ALDH1A1 1831/4885
US-20010041705-A1 Heterocyclic carboxamides HTR1A, HTR1D, NPY1R HPGD 691/4885KDM4E 1133/4885ALDH1A1 1831/4885

“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.