SCHEMBL4855812

SCHEMBL4855812

Cc1cc(C)n(-c2cc(Nc3c(Cl)cc(Cl)cc3Cl)nc(C)n2)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
HSD17B10 Q99714 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.42
KCNN3 Q9UGI6 2/20 0.42
CRHR1 P34998 1/20 0.41
MEN1 O00255 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
HTT P42858 2/20 0.39
THRB P10828 1/20 0.39
FTO Q9C0B1 1/20 0.39
MAPK10 P53779 1/20 0.39

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
SCHEMBL4846763 0.82 SLC34A1 (0.46) CRHR1
SCHEMBL4855605 0.79 MAPT (0.41) TSHRSMN1; SMN2KCNN3CRHR1MEN1
SCHEMBL4846780 0.76 CRHR1 (0.40) CRHR1
SCHEMBL4857708 0.75 CRHR1 (0.49) TSHRCRHR1MEN1CYP2C9CYP2C19
SCHEMBL4852355 0.74 CRHR1 (0.40) CRHR1
SCHEMBL31388502 0.73 SMN1; SMN2 (0.59) TSHRHSD17B10SMN1; SMN2KCNN3MEN1
SCHEMBL19687281 0.71 HTT (0.57) TSHRHSD17B10SMN1; SMN2MEN1CYP2C9
SCHEMBL21143766 0.71 HTT (0.57) TSHRHSD17B10SMN1; SMN2MEN1CYP2C9
SCHEMBL4853755 0.71 CRHR1 (0.43) TSHRCRHR1MEN1CYP2C9CYP2C19
SCHEMBL4848082 0.69 TP53 (0.49) TSHRHSD17B10CRHR1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7414059-B2 Pyrazolyl and imidazolyl pyrimidines as CRF antagonists ROCHE PALO ALTO LLC (US) 2008-08-19 US disclosed
US-7414059-B2 Pyrazolyl and imidazolyl pyrimidines as CRF antagonists ROCHE PALO ALTO LLC (US) 2008-08-19 US disclosed
US-7414059-B2 Pyrazolyl and imidazolyl pyrimidines as CRF antagonists ROCHE PALO ALTO LLC (US) 2008-08-19 US disclosed
US-20050113382-A1 Spiro tetrahydroquinazolines and dihydrocyclopentapyrimidines as CRF antagonists ROCHE PALO ALTO LLC 2005-05-26 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-20050113382-A1 Spiro tetrahydroquinazolines and dihydrocyclopentapyrimidines as CRF antagonists AVPR2, CRHR1, CRHR2 TSHR 248/4885HSD17B10 2806/4885SMN1; SMN2 2241/4885

“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.