SCHEMBL4525071

SCHEMBL4525071

Cc1ccccc1CN1C(=O)N(Cc2c(Cl)cccc2Cl)CC1(C)O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 8/20 0.42
MAPT P10636 1/20 0.39
AMPD2 Q01433 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.36
CXCR4 P61073 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL4510232 0.77 P2RX7 (0.58) P2RX7MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL4509520 0.75 MAPT (0.53) P2RX7MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL4514112 0.73 P2RX7 (0.46) P2RX7MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL4523295 0.69 CYP1A2 (0.64) P2RX7MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL4510323 0.69 P2RX7 (0.51) P2RX7CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL4511933 0.67 CYP1A2 (0.57) MAPTMEN1KMT2AALDH1A1CYP1A2
SCHEMBL4525501 0.67 P2RX7 (0.45) P2RX7MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4516861 0.64 CYP2D6 (0.58) P2RX7MEN1KMT2AALDH1A1CYP1A2
SCHEMBL4505471 0.64 P2RX7 (0.49) P2RX7MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL4513935 0.64 CYP2D6 (0.53) P2RX7KMT2AALDH1A1CYP1A2CYP3A4

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 3946/4885MAPT 4692/4885AMPD2 2557/4885

“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.