SCHEMBL3602203

SCHEMBL3602203

CCc1c(C)nn(C)c1Sc1cc(O)c(Cl)cc1Cl

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL3614211 0.83 HPGD (0.33) HPGDTSHRHSD17B10
SCHEMBL3607355 0.83 PTPN11 (0.35) NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL3603064 0.81 MAPT (0.32) SMN1; SMN2
SCHEMBL3608712 0.79 SMN1; SMN2 (0.39) SMN1; SMN2HPGDTSHRHSD17B10
SCHEMBL3609034 0.78 SMN1; SMN2 (0.36) NPC1RAB9ASMN1; SMN2
SCHEMBL3596945 0.78 TDP1 (0.41)
SCHEMBL3607426 0.77 ALDH1A1 (0.41) RAB9ASMN1; SMN2HPGDTSHRHSD17B10
SCHEMBL3615837 0.76 SMN1; SMN2 (0.37) SMN1; SMN2
SCHEMBL3615832 0.76 SMN1; SMN2 (0.37) SMN1; SMN2
SCHEMBL3614207 0.72 PTGDR2 (0.39) TSHR

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 NPC1 985/4885RAB9A 3163/4885SMN1; SMN2 4515/4885

“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.