SCHEMBL13040461

SCHEMBL13040461

Cc1cc(C=O)c(Nc2ccccc2N)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
GAA P10253 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 6/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPK14 Q16539 7/20 0.37
MAPK13 O15264 6/20 0.37
MAPK12 P53778 6/20 0.37
MAPK11 Q15759 6/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
TP53 P04637 1/20 0.37
APP P05067 1/20 0.37
HPGD P15428 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
SCHEMBL13688637 0.80 ALDH1A1 (0.36) ALDH1A1LMNACYP2C9CYP2C19TSHR
SCHEMBL13688636 0.80 MAPT (0.47) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL8241193 0.75 MAPK13 (0.45) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL13920985 0.75 MAPK13 (0.45) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL2541882 0.73 MAPT (0.41) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL935996 0.73 ALDH1A1 (0.50) MAPTGAAALDH1A1KDM4ELMNA
SCHEMBL12657206 0.72 MAPK14 (0.41) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL11754542 0.72 MAPT (0.50) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL6857358 0.70 SMN1; SMN2 (0.42) MAPTGAATDP1ALDH1A1KDM4E
SCHEMBL19260400 0.66 ALDH1A1 (0.46) MAPTALDH1A1KDM4ELMNAMEN1

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
EP-2264016-A2 A process for producing pure form form of 2-Methyl-4-(4-Methyl-1-Piperazinyl)-10h-thieno[2,3-B][1,5] benzodiazepine Jubilant Organosys Limited (IN) 2010-12-22 EP disclosed
US-20090221560-A1 Pharmaceutical Formulation ACTAVIS GROUP PTC EHF 2009-09-03 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-20090221560-A1 Pharmaceutical Formulation MC2R, SLC6A4, MC5R MAPT 392/4885GAA 1981/4885TDP1 3531/4885

“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.