SCHEMBL6218652

SCHEMBL6218652

COc1cc(Br)cc(Br)c1-n1c(C)c(C)c2c(Cl)nc(C)nc21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 14/20 0.38
ALDH1A1 P00352 1/20 0.35
PRNP P04156 1/20 0.35
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
CDK1 P06493 1/20 0.34
CCNB1 P14635 1/20 0.34
TDP1 Q9NUW8 1/20 0.32
NQO2 P16083 1/20 0.32

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
SCHEMBL6219189 0.89 CRHR1 (0.38) CRHR1TDP1
SCHEMBL6220728 0.86 CRHR1 (0.38) CRHR1TDP1
SCHEMBL6215835 0.85 CRHR1 (0.41) CRHR1TDP1
SCHEMBL6220396 0.85 CRHR1 (0.36) CRHR1TDP1
SCHEMBL6214389 0.83 CRHR1 (0.37) CRHR1TDP1
SCHEMBL6218662 0.81 CRHR1 (0.34) CRHR1TDP1
SCHEMBL1762903 0.81 CRHR1 (0.46) CRHR1TDP1
SCHEMBL6216295 0.79 CRHR1 (0.37) CRHR1ALDH1A1PRNPMAPTNPSR1
SCHEMBL6217183 0.78 CRHR1 (0.40) CRHR1TDP1
SCHEMBL6217578 0.77 CRHR1 (0.36) CRHR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1176146-B1 CARBAMOYL TETRAHYDROPYRIDINE DERIVATIVES TAISHO PHARMACEUTICAL CO LTD (JP) 2005-06-08 EP disclosed
US-6894168-B2 Carbamoyl tetrahydropyridine derivatives TAISHO PHARMACEUTICAL CO., LTD. (JP) 2005-05-17 US disclosed
EP-1449843-A1 Intermediates for the preparation of carbamoyl tetrahydropyridine derivatives Taisho Pharmaceutical Co. Ltd. (JP) 2004-08-25 EP disclosed
US-20030191122-A1 Carbamoyl tetrahydropyridine derivatives NAKAZATO ATSURO (JP) 2003-10-09 US disclosed
US-6600038-B1 Intermediates for the preparation thereof are provided. The derivatives described above are effective for diseases which are believed to involve CRF. involving Corticotropin Releasing Factor (CRF), such as depression, anxiety, TAISHO PHARMACEUTICAL CO., LTD. (JP) 2003-07-29 US disclosed
EP-1176146-A1 CARBAMOYL TETRAHYDROPYRIDINE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD (JP) 2002-01-30 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 (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-20030191122-A1 Carbamoyl tetrahydropyridine derivatives CNR1, CRHR1, CRH CRHR1 2/4885ALDH1A1 3115/4885PRNP 826/4885

“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.