SCHEMBL4244744

SCHEMBL4244744

CC(C)(C)c1ccc(CC2CCN(C(=O)O)CC2)cc1.NC(=O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 3/20 0.53
GAA P10253 1/20 0.53
NR4A2 P43354 1/20 0.52
RXRA P19793 1/20 0.52
RXRB P28702 1/20 0.52
SLC6A5 Q9Y345 3/20 0.49
MAOB P27338 1/20 0.48
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
KMT2A Q03164 1/20 0.47
LTB4R Q15722 1/20 0.47
LTB4R2 Q9NPC1 1/20 0.47
CHRM4 P08173 1/20 0.46
SMN1; SMN2 Q16637 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
SCHEMBL27689236 0.92 PARP10 (0.52) PARP10GAANR4A2RXRARXRB
SCHEMBL4246345 0.91 PARP10 (0.64) PARP10GAANR4A2MEN1POLB
SCHEMBL4245174 0.89 PARP10 (0.60) PARP10GAAMEN1POLBKMT2A
SCHEMBL4239346 0.89 PARP10 (0.56) PARP10GAAMEN1POLBKMT2A
SCHEMBL4244568 0.86 GAA (0.52) GAA
SCHEMBL4244741 0.85 SLC6A5 (0.53) NR4A2RXRARXRBSLC6A5MEN1
SCHEMBL27670250 0.83 PARP10 (0.61) PARP10NR4A2MAOBCHRM4
SCHEMBL27689205 0.82 PARP10 (0.58) PARP10MAOBCHRM4
SCHEMBL4251983 0.82 PARP10 (0.62) PARP10GAANR4A2MAOB
SCHEMBL27670152 0.80 PARP10 (0.58) PARP10NR4A2MAOBMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170901-A1 Benzoyl Urea Derivatives RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2009-07-02 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-20090170901-A1 Benzoyl Urea Derivatives OPRM1, GRIN2C, GRIN3A PARP10 3694/4885GAA 3604/4885NR4A2 286/4885

“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.