SCHEMBL4511191

SCHEMBL4511191

Cc1ccccc1CN1CCC(C(=O)c2c(Cl)cccc2Cl)C1=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.47
TNKS O95271 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
CXCR4 P61073 1/20 0.43
ALDH1A1 P00352 3/20 0.43
CCR3 P51677 1/20 0.41
MAPT P10636 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 2/20 0.39
ACHE P22303 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
SCHEMBL4505622 0.79 MGLL (0.44) P2RX7KMT2AMEN1ALDH1A1KDM4E
SCHEMBL4505471 0.76 P2RX7 (0.49) P2RX7TNKSTNKS2SMN1; SMN2KMT2A
SCHEMBL4523199 0.72 CHRM2 (0.56) P2RX7SMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL4514642 0.72 P2RX7 (0.47) P2RX7SMN1; SMN2KMT2AMEN1CXCR4
SCHEMBL4525501 0.71 P2RX7 (0.45) P2RX7SMN1; SMN2KMT2AMEN1CXCR4
SCHEMBL4523295 0.71 CYP1A2 (0.64) P2RX7SMN1; SMN2KMT2AMEN1CXCR4
SCHEMBL4504036 0.70 P2RX7 (0.41) P2RX7KMT2AMEN1ALDH1A1KDM4E
SCHEMBL4504033 0.70 P2RX7 (0.41) P2RX7KMT2AMEN1ALDH1A1KDM4E
SCHEMBL4510232 0.70 P2RX7 (0.58) P2RX7SMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL4510331 0.68 KDM4E (0.39) P2RX7KMT2AMEN1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 EP disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes HSD11B1, HSD17B1, HSD11B2 P2RX7 3946/4885TNKS 3878/4885TNKS2 4424/4885

“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.