SCHEMBL14973183

SCHEMBL14973183

Cn1ncc(-c2nnc(-c3ccc(S(N)(=O)=O)cc3)o2)c1COc1ccc(C(F)(F)F)cn1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.49
CA1 P00915 11/20 0.49
MAOA P21397 4/20 0.41
MAOB P27338 4/20 0.41
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ADAMTS4 O75173 1/20 0.39
CHRNA7 P36544 1/20 0.38
KIF11 P52732 1/20 0.37

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
SCHEMBL14973073 0.90 CA1 (0.44) CA2CA1MAOAMAOBKDM4E
SCHEMBL14972940 0.89 CA2 (0.47) CA2CA1MAOAMAOBKDM4E
SCHEMBL14972950 0.86 S1PR1 (0.46) CA2CA1ADAMTS4
SCHEMBL11949404 0.84 KDM4E (0.38) KDM4EMEN1KMT2ASMN1; SMN2ADAMTS4
SCHEMBL10060110 0.82 CA2 (0.45) CA2CA1MAOAMAOBKDM4E
SCHEMBL14973125 0.79 CA2 (0.49) CA2CA1MAOAMAOBKDM4E
SCHEMBL11949393 0.78 MRGPRX4 (0.43) KDM4EMEN1KMT2ASMN1; SMN2ADAMTS4
SCHEMBL14973178 0.78 S1PR1 (0.38) CA2CA1MEN1KMT2AADAMTS4
SCHEMBL14973059 0.78 CA9 (0.45) CA2CA1MEN1KMT2A
SCHEMBL14973325 0.78 MAOB (0.53) CA2CA1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2604602-A1 HETEROARYL-PYRAZOLE DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2013-06-19 EP disclosed
US-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2013-05-30 US disclosed
US-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2013-05-30 US disclosed
US-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2013-05-30 US 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-20130137865-A1 HETEROARYL-PYRAZOLE DERIVATIVE GRIN2C, GRIN2B, GRIN3A CA2 2244/4885CA1 1915/4885MAOA 1641/4885

“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.