SCHEMBL148273

SCHEMBL148273

O=c1[nH]c2cc(O)ccc2c2oc3cc([N+](=O)[O-])ccc3c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49
PARP1 P09874 2/20 0.48
CDK5 Q00535 3/20 0.47
CDK5R1 Q15078 3/20 0.47
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MGAM O43451 1/20 0.46
NR1I2 O75469 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ESR1 P03372 1/20 0.46
GLA P06280 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
THRB P10828 1/20 0.46
HPGD P15428 1/20 0.46
CSNK2A2 P19784 1/20 0.46

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
SCHEMBL3888726 0.86 CDK5 (0.61) LMNACA12CA9CDK5CDK5R1
SCHEMBL7252779 0.85 MEN1 (0.55) CA12CA9PARP1CDK5CDK5R1
SCHEMBL9768422 0.80 CDK5 (0.50) LMNACA12CA9CDK5CDK5R1
SCHEMBL31506760 0.79 CDK5 (0.52) LMNACDK5CDK5R1MEN1MAPT
SCHEMBL10664986 0.79 CDK5 (0.52) LMNACDK5CDK5R1MEN1MAPT
SCHEMBL9781435 0.77 ESR2 (0.56) LMNACDK5CDK5R1MEN1MAPT
SCHEMBL9781515 0.77 CDK5 (0.64) LMNACA12CA9CDK5CDK5R1
SCHEMBL9781428 0.77 CDK5 (0.62) LMNACA12CA9CDK5CDK5R1
SCHEMBL26628216 0.76 MEN1 (0.62) LMNACA12CA9CDK5CDK5R1
SCHEMBL9781518 0.75 CDK5 (0.46) LMNACA12CA9CDK5CDK5R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003020698-A2 PROTEIN TYROSINE KINASE INHIBITORS PROCHON BIOTECH LTD. (IL) 2003-03-13 WO claimed
US-20140221455-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR Verva Pharmaceuticals, Inc. (AU) 2014-08-07 US disclosed
US-20120059047-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR VERVA PHARMACEUTICALS PTY LTD (AU) 2012-03-08 US disclosed
US-20050282733-A1 Differentiation modulating agents and uses therefor VERVA PHARMACEUTICALS PTY LTD (AU) 2005-12-22 US disclosed
WO-2005065686-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR ADIPOGEN PHARMACEUTICALS PTY LIMITED (AU) 2005-07-21 WO disclosed
WO-2003020698-A2 PROTEIN TYROSINE KINASE INHIBITORS PROCHON BIOTECH LTD. (IL) 2003-03-13 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 (2 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-20120059047-A1 DIFFERENTIATION MODULATING AGENTS AND USES THEREFOR FGF1, FABP4, FGF2 LMNA 2790/4885CA12 4047/4885CA9 4561/4885
US-20050282733-A1 Differentiation modulating agents and uses therefor FGF1, FABP4, FGF2 LMNA 2790/4885CA12 4047/4885CA9 4561/4885

“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.