SCHEMBL3602126

SCHEMBL3602126

C=Cc1c(C)nn(C)c1Oc1cc(OCC(=O)NCC2CC2)c(Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
LMNA P02545 2/20 0.38
HPGD P15428 4/20 0.36
PKM P14618 3/20 0.35
ALDH1A1 P00352 3/20 0.35
RAB9A P51151 3/20 0.35
HTT P42858 1/20 0.35
NR2F2 P24468 1/20 0.35
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
FAAH O00519 2/20 0.34
BCHE P06276 2/20 0.34
ACHE P22303 2/20 0.34
SHMT2 P34897 1/20 0.34
KCNJ6 P48051 2/20 0.34
KCNJ5 P48544 2/20 0.34

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
SCHEMBL3609830 0.83 NR2F2 (0.37) SMN1; SMN2LMNAPKMALDH1A1RAB9A
SCHEMBL3609386 0.83 SMN1; SMN2 (0.38) SMN1; SMN2LMNAHPGDPKMALDH1A1
SCHEMBL3617492 0.79 L3MBTL1 (0.39) SMN1; SMN2LMNAALDH1A1HTTMAPT
SCHEMBL3606304 0.74 PPOX (0.40) KMT2AMEN1SMN1; SMN2LMNAHPGD
SCHEMBL3605551 0.74 SMN1; SMN2 (0.39) SMN1; SMN2LMNAHPGDALDH1A1MAPT
SCHEMBL3607161 0.73 SMN1; SMN2 (0.40) SMN1; SMN2HTTNR2F2MAPT
SCHEMBL3612119 0.72 SMN1; SMN2 (0.36) SMN1; SMN2HTTNR2F2MAPTSHMT2
SCHEMBL3605072 0.72 KDM4E (0.39) SMN1; SMN2HPGDALDH1A1RAB9AHTT
SCHEMBL3608916 0.72 KDM4E (0.39) SMN1; SMN2HPGDALDH1A1RAB9AHTT
SCHEMBL3609770 0.72 SMN1; SMN2 (0.37) SMN1; SMN2HTTNR2F2MAPT

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 KMT2A 2269/4885MEN1 2280/4885SMN1; 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.