SCHEMBL12789060

SCHEMBL12789060

Cc1nc2ccc(OCCCC3CCN(C(=O)OC(C)(C)C)CC3)cc2c(=O)n1C(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 9/20 0.51
▸ CHEK2 O96017 1/20 0.44
▸ CSF1R P07333 2/20 0.44
▸ KDR P35968 1/20 0.44
▸ PDE3B Q13370 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ SGMS1 Q86VZ5 4/20 0.43
▸ SGMS2 Q8NHU3 4/20 0.43
▸ YAP1 P46937 2/20 0.41

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
SCHEMBL12847385 0.86 ACHE (0.43) —
SCHEMBL12788962 0.80 MEN1 (0.45) GPR119
SCHEMBL12789518 0.79 HTT (0.41) PDE3BPDE3A
SCHEMBL12788473 0.77 ACHE (0.43) PDE3BPDE3A
SCHEMBL12788957 0.76 MEN1 (0.45) GPR119
SCHEMBL12788964 0.75 PDK2 (0.44) GPR119
SCHEMBL13249889 0.75 KDM4E (0.41) GPR119
SCHEMBL12789075 0.75 DRD2 (0.43) —
SCHEMBL13329327 0.74 KDM4E (0.42) GPR119
SCHEMBL12788465 0.74 SMN1; SMN2 (0.45) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110065671-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND USE THEREOF AS GPR119 MODULATORS MERCK SHARP & DOHME CORP. 2011-03-17 — — US disclosed
US-20110065671-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND USE THEREOF AS GPR119 MODULATORS MERCK SHARP & DOHME CORP. 2011-03-17 — — 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-20110065671-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND USE THEREOF AS GPR119 MODULATORS GPR119, GPR39, GPR65 GPR119 1/4885CHEK2 3460/4885CSF1R 455/4885

“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.

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