SCHEMBL2496571

SCHEMBL2496571

CCCCc1nc(Br)c(-c2c(C)nn3c(C(CC)CC)cc(C)nc23)s1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 15/20 0.37
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
DCTPP1 Q9H773 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL2497805 0.86 HPGD (0.38) CRHR1POLBHPGDPI4KBKDM4E
SCHEMBL2929387 0.86 CRHR1 (0.36) CRHR1POLBHPGDPI4KBKDM4E
SCHEMBL2502974 0.81 KDM4E (0.40) CRHR1POLBHPGDPI4KBKDM4E
SCHEMBL2499635 0.80 HPGD (0.34) CRHR1POLBHPGDPI4KBKDM4E
SCHEMBL2931270 0.80 HPGD (0.39) CRHR1POLBHPGDPI4KBKDM4E
SCHEMBL2497127 0.80 CRHR1 (0.38) CRHR1POLBHPGDPI4KBKDM4E
SCHEMBL545543 0.78 HPGD (0.40) CRHR1POLBHPGDPI4KBKDM4E
SCHEMBL22958812 0.78 HPGD (0.35) CRHR1POLBHPGDKDM4EMAPT
SCHEMBL2500610 0.78 HPGD (0.37) CRHR1POLBHPGDPI4KBKDM4E
SCHEMBL544959 0.77 CRHR1 (0.40) CRHR1POLBHPGDKDM4EMAPT

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-8030304-B2 Thiazole pyrazolopyrimidines CRF1 receptor antagonists ELI LILLY AND COMPANY (US) 2011-10-04 US disclosed
EP-2094709-B1 THIAZOLE PYRAZOLOPYRIMIDINES AS CRF1 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2010-09-15 EP disclosed
US-20100222339-A1 Thiazole pyrazolopyrimidines CRF1 receptor antagonists ELI LILLY AND COMPANY 2010-09-02 US 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-20100222339-A1 Thiazole pyrazolopyrimidines CRF1 receptor antagonists CRHR1, CRH, CRHR2 CRHR1 1/4885POLB 4776/4885HPGD 1864/4885

“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.