SCHEMBL4040963

SCHEMBL4040963

CCCCNC(=O)C(CC(O)[CH]Cc1ccccc1)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.47
NAAA Q02083 2/20 0.44
MMP8 P22894 2/20 0.43
HPGD P15428 1/20 0.42
LMNA P02545 1/20 0.42
PAX8 Q06710 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2D6 P10635 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TLR2 O60603 1/20 0.41
CYP1A2 P05177 1/20 0.40
KCNA3 P22001 1/20 0.40
KDM4A O75164 1/20 0.40

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
SCHEMBL3936972 1.00 REN (0.47) RENNAAAMMP8HPGDLMNA
SCHEMBL4047233 0.90 CHRND (0.44) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL5730463 0.90 REN (0.41) RENNAAA
SCHEMBL4038910 0.88 CHRND (0.48) REN
SCHEMBL4037775 0.86 REN (0.49) REN
SCHEMBL4043492 0.85 VNN1 (0.39) RENMMP8
SCHEMBL4039170 0.85 HPGD (0.41) MMP8HPGDLMNAALDH1A1
SCHEMBL4044987 0.84 MMP8 (0.51) MMP8KMT2AALDH1A1
SCHEMBL4041195 0.82 MMP1 (0.41) RENMMP8
SCHEMBL4039656 0.79 HDAC1 (0.42) LMNAALDH1A1

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
EP-1436291-B1 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA SA (FR) 2009-01-14 EP disclosed
US-20070238734-A1 JNK INHIBITORS SANOLI-AVENTIS (FR) 2007-10-11 US disclosed
US-7148215-B2 Prodrugs as antihistamines or anticarcinogenic agents AVENTIS PHARMA S.A. (FR) 2006-12-12 US disclosed
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents AVENTIS PHARMA S.A, (FR) 2005-01-13 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 (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-20070238734-A1 JNK INHIBITORS MAP3K7, MAPKAPK2, MAPK7 REN 1337/4885NAAA 4690/4885MMP8 1842/4885
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents CNKSR1, ROS1, NRAS REN 2191/4885NAAA 3447/4885MMP8 1228/4885

“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.