SCHEMBL9106572

SCHEMBL9106572

Cc1ccc(C(=O)/C=C/N(C)C)cc1NC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.47
LMNA P02545 4/20 0.47
ALDH1A1 P00352 9/20 0.44
HPGD P15428 3/20 0.44
RAB9A P51151 6/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
RECQL P46063 2/20 0.43
ALOX12 P18054 1/20 0.43
HTT P42858 4/20 0.42
GAA P10253 2/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
NPC1 O15118 3/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 2/20 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
SCHEMBL9106575 1.00 MAPT (0.47) MAPTLMNAALDH1A1HPGDRAB9A
SCHEMBL7084616 0.81 MAPT (0.52) MAPTLMNAALDH1A1HPGDRAB9A
SCHEMBL7084615 0.81 MAPT (0.52) MAPTLMNAALDH1A1HPGDRAB9A
SCHEMBL6126546 0.81 MAPT (0.38) MAPTLMNAALDH1A1HPGDRAB9A
SCHEMBL2283371 0.79 PPARG (0.51) MAPTLMNAALDH1A1RAB9AALOX12
SCHEMBL9104625 0.79 CA12 (0.44) MAPTLMNAALDH1A1RAB9ACYP1A2
SCHEMBL13872958 0.79 MAPT (0.52) MAPTLMNAALDH1A1HPGDRAB9A
SCHEMBL10318265 0.78 ALDH1A1 (0.50) MAPTLMNAALDH1A1HPGDGAA
SCHEMBL9102483 0.78 MLYCD (0.40) MAPTLMNAALDH1A1CYP1A2CYP2C19
SCHEMBL11982645 0.77 HDAC1 (0.46) HDAC1HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8563558-B2 Substituted pyridine urea compounds CONFLUENCE LIFE SCIENCES, INC. (US) 2013-10-22 US disclosed
WO-2012078673-A1 SUBSTITUTED PYRIDINE UREA COMPOUNDS CONFLUENCE LIFE SCIENCES, INC. (US) 2012-06-14 WO disclosed
US-20120142708-A1 SUBSTITUTED PYRIDINE UREA COMPOUNDS ACLARIS THERAPEUTICS, INC. 2012-06-07 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-20120142708-A1 SUBSTITUTED PYRIDINE UREA COMPOUNDS MAPK1, MAP3K1, MAP3K8 MAPT 694/4885LMNA 3157/4885ALDH1A1 2802/4885

“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.