SCHEMBL12198367

SCHEMBL12198367

Fc1cc(C2CCCCC2)cc(F)c1OC1CN(Cc2ccc3ccccc3c2)C1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
MCHR1 Q99705 3/20 0.41
S1PR1 P21453 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CCR3 P51677 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
PDE2A O00408 2/20 0.39
CHKA P35790 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRL1 P41146 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
SCHEMBL1668306 0.85 KMT2A (0.43) ACHEKMT2AMEN1MCHR1SLC6A2
SCHEMBL1670849 0.84 CCR3 (0.46) ACHEKMT2AMEN1MCHR1CCR3
SCHEMBL12198368 0.82 TSHR (0.44) ACHEKMT2AMEN1SLC6A4SLC6A3
SCHEMBL12198363 0.77 S1PR1 (0.35) S1PR1SIGMAR1
SCHEMBL12198419 0.74 ADRB2 (0.46) ACHEPDE2A
SCHEMBL12198393 0.72 LMNA (0.44) KMT2AMEN1
SCHEMBL12198394 0.72 GPR119 (0.39) SIGMAR1
SCHEMBL12198392 0.72 GPR119 (0.39) KMT2AMEN1
SCHEMBL12198361 0.71 PDE9A (0.33) PDE2A
SCHEMBL12198403 0.71 SCN1A (0.36)

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-8575168-B2 Compounds and compositions as modulators of GPR119 activity IRM LLC (BM) 2013-11-05 US disclosed
US-20110245220-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-06 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-20110245220-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY GPR119, GPR65, GPR39 ACHE 3242/4885KMT2A 3355/4885MEN1 3081/4885

“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.