SCHEMBL2072338

SCHEMBL2072338

Cc1cc(C)c(-c2cn(C)c3nc(NC4CCCC4)n(C)c(=O)c23)c(C)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 7/20 0.62
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 3/20 0.38
CCNB2 O95067 1/20 0.38
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38
FGFR1 P11362 1/20 0.37
PDE7A Q13946 3/20 0.36
PDE4B Q07343 2/20 0.36
PDE5A O76074 1/20 0.36
KAT2B Q92831 1/20 0.35
KDM4E B2RXH2 1/20 0.35
BRD4 O60885 1/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL2073108 0.82 CRHR1 (0.63) CRHR1MAPK1FGFR1
SCHEMBL2072641 0.80 CRHR1 (0.66) CRHR1TSHRTP53MAPK1HSD17B10
SCHEMBL2071923 0.78 CRHR1 (0.98) CRHR1TSHRMAPK1POLBKMT2A
SCHEMBL2070099 0.77 CRHR1 (0.62) CRHR1MAPK1
SCHEMBL2070607 0.77 CRHR1 (0.65) CRHR1PDE4BPDE5AKDM4E
SCHEMBL2071226 0.77 CRHR1 (1.00) CRHR1TSHRMAPK1POLBKMT2A
SCHEMBL2071628 0.76 CRHR1 (0.58) CRHR1TP53
SCHEMBL2071132 0.76 CRHR1 (0.61) CRHR1MAPK1
SCHEMBL2072342 0.76 CRHR1 (0.57) CRHR1POLBKDM4EKMT2A
SCHEMBL2071874 0.75 CRHR1 (0.76) CRHR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2522670-A1 Heterocyclic CRF receptor antagonists Takeda Pharmaceutical Company Limited (JP) 2012-11-14 EP disclosed
US-7897607-B2 Cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-01 US disclosed
US-7897607-B2 Cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-01 US disclosed
US-7897607-B2 Cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-01 US disclosed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 US disclosed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 US disclosed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 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-20070179165-A1 Cyclic compounds CRHR1, CRHR2, MC2R CRHR1 1/4885TSHR 311/4885TP53 4425/4885

“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.