SCHEMBL2970402

SCHEMBL2970402

COC(=O)c1cnc(N2CCc3c([nH]c4ccc(C)cc34)C2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 1/20 0.47
LMNA P02545 1/20 0.47
PABPC1 P11940 1/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HDAC1 Q13547 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TRPV1 Q8NER1 2/20 0.43
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
GLA P06280 1/20 0.41
OGA O60502 1/20 0.41
CDK4 P11802 2/20 0.41
CCND1 P24385 2/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL2977779 0.92 BAZ2B (0.55) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL2981880 0.89 BAZ2B (0.48) BAZ2BLMNAHDAC1HDAC6MEN1
SCHEMBL2979134 0.88 HDAC6 (0.60) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL2969790 0.86 TRPV1 (0.50) HDAC1HDAC6TRPV1CDK4CCND1
SCHEMBL2970696 0.81 BAZ2B (0.56) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL2980788 0.81 BAZ2B (0.56) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL2968778 0.80 HDAC6 (0.50) HDAC1HDAC6TRPV1CDK4CCND1
SCHEMBL2965905 0.80 HDAC1 (0.65) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL2979518 0.79 HDAC6 (0.67) BAZ2BLMNAHDAC1HDAC6ALOX15
SCHEMBL5452027 0.79 HDAC1 (0.54) BAZ2BLMNAHDAC1HDAC6CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772245-B2 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-7772245-B2 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-7772245-B2 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-20060199829-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS, INC. 2006-09-07 US disclosed
WO-2006088949-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS INHIBITORS OF HISTONE DEACETYLASE MIIKANA THERAPEUTICS, INC. (US) 2006-08-24 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-20060199829-A1 Inhibitors of histone deacetylase HDAC1, HDAC2, HDAC11 BAZ2B 33/4885LMNA 1126/4885PABPC1 2514/4885

“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.