SCHEMBL3608255

SCHEMBL3608255

COCOc1cc(O)c(C)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.40
LMNA P02545 1/20 0.38
RET P07949 1/20 0.37
KDR P35968 1/20 0.37
CYP2C19 P33261 3/20 0.36
ALDH1A1 P00352 2/20 0.36
POLB P06746 2/20 0.36
MAPT P10636 2/20 0.36
CYP2C9 P11712 2/20 0.36
HPGD P15428 2/20 0.36
ALOX12 P18054 2/20 0.36
MAPK1 P28482 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
KMT2A Q03164 1/20 0.36
MAOA P21397 1/20 0.35
KDM4E B2RXH2 2/20 0.33
CYP1A2 P05177 2/20 0.33

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
SCHEMBL17625691 0.83 LMNA (0.41) ACLYLMNACYP2C19ALDH1A1POLB
SCHEMBL3611033 0.79 LMNA (0.39) ACLYLMNAALDH1A1MAPTHPGD
SCHEMBL19914317 0.79 GAA (0.47) RETKDRCYP2C19ALDH1A1MAPT
SCHEMBL18768220 0.77 LMNA (0.38) ACLYLMNACYP2C19ALDH1A1POLB
SCHEMBL1391291 0.77 ERN1 (0.41) ACLYLMNAALDH1A1DPP4BACE1
SCHEMBL13791043 0.74 MAPT (0.62) LMNACYP2C19ALDH1A1POLBMAPT
SCHEMBL16096116 0.73 BACE1 (0.46) ACLYLMNARETKDRCYP2C19
SCHEMBL3721034 0.73 HSD17B10 (0.43) CYP2C19MAPTCYP1A2CYP3A4HSD17B10
SCHEMBL18768219 0.71 HTR2A (0.37) LMNAALDH1A1POLBMAPTNPSR1
SCHEMBL13540675 0.71 GAA (0.47) LMNARETKDRCYP2C19ALDH1A1

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-20100016396-A1 PYRAZOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-21 US disclosed
EP-2128138-A1 PYRAZOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-12-02 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-20100016396-A1 PYRAZOLE COMPOUND SLC5A1, SLC5A2, GLP1R ACLY 1425/4885LMNA 4306/4885RET 2862/4885

“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.