Sugi Predict

Sugi Predict / Compounds / SCHEMBL8201149

SCHEMBL8201149

SCHEMBL8201149

Cc1cc(C)c(-n2nnc3c(-c4ccccc4C(F)(F)F)nc(C)nc32)c(C)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 17/20 1.00
▸ HSD11B1 P28845 3/20 0.42

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
SCHEMBL8213843 0.76 CRHR1 (1.00) CRHR1
SCHEMBL8045813 0.73 CRHR1 (0.57) CRHR1
SCHEMBL8211979 0.65 CRHR1 (0.62) CRHR1
SCHEMBL6302111 0.61 CRHR1 (0.57) CRHR1
SCHEMBL6094839 0.61 CRHR1 (0.49) CRHR1
SCHEMBL13147201 0.60 TRPA1 (0.51) CRHR1HSD11B1
SCHEMBL10832913 0.60 HSD11B1 (0.47) CRHR1HSD11B1
SCHEMBL18131669 0.59 PTPN1 (0.46) CRHR1HSD11B1
SCHEMBL2749101 0.59 HSD11B1 (1.00) HSD11B1
SCHEMBL2747354 0.58 HSD11B1 (1.00) HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6103737-A Aryl- and arylamino- substituted heterocycles as corticotropin releasing hormone antagonists DUPONT PHARMACEUTICALS COMPANY (US) 2000-08-15 — — US disclosed
EP-0994860-A1 ARYL-AND ARYLAMINO-SUBSTITUTED HETEROCYCLES AS CORTICOTROPIN RELEASING HORMONE ANTAGONISTS Du Pont Pharmaceuticals Company (US) 2000-04-26 — — EP disclosed
WO-1999001439-A1 ARYL-AND ARYLAMINO-SUBSTITUTED HETEROCYCLES AS CORTICOTROPIN RELEASING HORMONE ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 1999-01-14 — — WO disclosed