SCHEMBL4133822

SCHEMBL4133822

CC(C)(C)c1ccc(S(=O)(=O)Nc2cnc3[nH]c(C(=O)Nc4nccs4)c(-c4ccccc4)c3c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
ALDH1A1 P00352 5/20 0.45
MAPT P10636 3/20 0.45
CNR1 P21554 3/20 0.45
RECQL P46063 2/20 0.45
HTT P42858 2/20 0.45
GPR55 Q9Y2T6 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
SERPINE1 P05121 1/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 3/20 0.43
CA1 P00915 1/20 0.43
CYP3A4 P08684 1/20 0.43
PTGS1 P23219 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL4144514 0.88 ALDH1A1 (0.49) MEN1KMT2AALDH1A1HTTTDP1
SCHEMBL4072140 0.88 SERPINE1 (0.42) MEN1KMT2AALDH1A1MAPTCNR1
SCHEMBL3957017 0.85 SERPINE1 (0.54) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL13910226 0.84 SERPINE1 (0.51) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL3957351 0.84 SERPINE1 (0.49) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL4142121 0.84 MAP2 (0.54) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL13906321 0.83 SERPINE1 (0.48) MEN1KMT2AALDH1A1HTTSERPINE1
SCHEMBL13906365 0.82 SERPINE1 (0.47) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL13872834 0.81 SERPINE1 (0.51) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL3961633 0.81 SERPINE1 (0.47) MEN1KMT2AALDH1A1MAPTHTT

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-20090098189-A1 AZAINDOLES AS INHIBITORS OF SOLUBLE ADENYLATE CYCLASE BAYER SCHERING PHARMA AG (DE) 2009-04-16 US claimed
US-20090098189-A1 AZAINDOLES AS INHIBITORS OF SOLUBLE ADENYLATE CYCLASE BAYER SCHERING PHARMA AG (DE) 2009-04-16 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-20090098189-A1 AZAINDOLES AS INHIBITORS OF SOLUBLE ADENYLATE CYCLASE ADCY1, ADCY5, ADCY2 MEN1 932/4885KMT2A 2841/4885ALDH1A1 327/4885

“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.