SCHEMBL3095587

SCHEMBL3095587

COc1ccc(-c2cc(C(Cl)CC(C)C)c(C)o2)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CRHR1 P34998 10/20 0.34
TAS1R3 Q7RTX0 4/20 0.34
TAS1R1 Q7RTX1 4/20 0.34
PTGES O14684 1/20 0.32
PTPN1 P18031 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
SCHEMBL3102377 0.86 KDM4E (0.36) MAPTTAS1R3TAS1R1
SCHEMBL3098641 0.85 CA12 (0.40) POLBMAPTHPGDTSHRHSD17B10
SCHEMBL3091435 0.84 EGFR (0.44) POLBMAPTHPGDHSD17B10
SCHEMBL3101023 0.81 SMN1; SMN2 (0.42) MAPTHPGDTSHRHSD17B10
SCHEMBL3106697 0.80 KDM4E (0.40) POLBMAPTHPGDTSHRHSD17B10
SCHEMBL3099222 0.76 GNRHR (0.37) POLBMAPTHPGDTSHRHSD17B10
SCHEMBL3101526 0.75 CYP11B1 (0.38)
SCHEMBL3107457 0.73 GAA (0.41) POLBMAPTHPGDTSHRHSD17B10
SCHEMBL3110128 0.72 MAOB (0.36) POLBMAPTHPGDHSD17B10
SCHEMBL3109147 0.72 CA12 (0.38) MAPTHPGDTAS1R3TAS1R1

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
EP-2210876-B1 HETEROCYCLIC COMPOUND AS GLUCAGON ANTAGONIST TAKEDA PHARMACEUTICAL (JP) 2015-05-20 EP disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
EP-2210876-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-07-28 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-20100256156-A1 HETEROCYCLIC COMPOUND GLP1R, GPR119, GCGR POLB 4758/4885MAPT 4877/4885HPGD 1354/4885

“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.