SCHEMBL2992236

SCHEMBL2992236

Cc1ccn2c(NCCc3ccccc3)c(-c3ccccc3O)nc2c1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.63
MAPT P10636 7/20 0.63
NR1H4 Q96RI1 3/20 0.57
SMN1; SMN2 Q16637 4/20 0.53
POLB P06746 2/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53
ALDH1A1 P00352 1/20 0.53
RAB9A P51151 1/20 0.53
TP53 P04637 4/20 0.50
RXFP1 Q9HBX9 1/20 0.50
PKM P14618 1/20 0.47
PKLR P30613 1/20 0.47
ATM Q13315 2/20 0.46
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
GFER P55789 1/20 0.45
KMT2A Q03164 1/20 0.45
THRB P10828 1/20 0.44

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
SCHEMBL2977673 0.92 GAA (0.59) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2990971 0.90 MAPT (0.57) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2989961 0.90 GAA (0.67) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2989981 0.86 GAA (0.64) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2992363 0.84 GAA (0.72) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2988133 0.83 MAPT (0.64) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2992275 0.83 GAA (0.61) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2993469 0.83 GAA (0.67) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2979602 0.82 GAA (0.60) GAAMAPTNR1H4SMN1; SMN2POLB
SCHEMBL2988829 0.82 GAA (0.60) GAAMAPTNR1H4SMN1; SMN2POLB

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
US-20100173930-A1 Certain Chemical Entities, Compositions and Methods CYTOKINETICS, INC. 2010-07-08 US claimed
WO-2008016648-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-02-07 WO claimed
US-20100173930-A1 Certain Chemical Entities, Compositions and Methods CYTOKINETICS, INC. 2010-07-08 US disclosed
WO-2008016648-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-02-07 WO 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-20100173930-A1 Certain Chemical Entities, Compositions and Methods TNNC1, TNNI3, TNNT2 GAA 820/4885MAPT 218/4885NR1H4 4747/4885

“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.