SCHEMBL6490670

SCHEMBL6490670

COC(=O)c1ccccc1COc1ccc(NC(=O)OC(C)(C)C)c(N)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.44
LNPEP Q9UIQ6 2/20 0.43
PTPN1 P18031 1/20 0.42
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 4/20 0.41
CYP1A2 P05177 3/20 0.41
KDM4E B2RXH2 3/20 0.41
CYP2C19 P33261 2/20 0.41
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HIF1A Q16665 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
PARP10 Q53GL7 2/20 0.40
OPRL1 P41146 2/20 0.40
PARP15 Q460N3 1/20 0.40
PARP14 Q460N5 1/20 0.40
ERAP2 Q6P179 1/20 0.39
ATR Q13535 1/20 0.39
HSD17B10 Q99714 2/20 0.39
CFTR P13569 1/20 0.39

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
SCHEMBL6493102 0.86 LNPEP (0.49) LNPEPRAB9AALDH1A1CYP1A2KDM4E
SCHEMBL6490529 0.84 SMN1; SMN2 (0.46) RAB9AALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL28626965 0.78 AAK1 (0.46) HDAC1RAB9AALDH1A1CYP1A2SMN1; SMN2
SCHEMBL7125817 0.78 HDAC1 (0.41) HDAC1PTPN1RXFP1KMT2A
SCHEMBL6490108 0.77 NR1H2 (0.41) HDAC1PTPN1RAB9AALDH1A1KDM4E
SCHEMBL29765467 0.77 AAK1 (0.46) HDAC1ALDH1A1KDM4ESMN1; SMN2MAPT
SCHEMBL246277 0.77 AAK1 (0.46) HDAC1ALDH1A1KDM4ESMN1; SMN2MAPT
SCHEMBL5563988 0.75 CYP1A2 (0.45) HDAC1ALDH1A1CYP1A2KDM4ESMN1; SMN2
SCHEMBL9330701 0.75 KMT2A (0.61) ALDH1A1CYP1A2KDM4ECYP2C19HPGD
SCHEMBL3995767 0.74 NAMPT (0.47) HDAC1PTPN1RAB9AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US disclosed
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 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-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD HDAC1 50/4885LNPEP 3433/4885PTPN1 2165/4885

“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.