SCHEMBL3742201

SCHEMBL3742201

NC(=O)c1ccc(C(N)=O)o1.[PbH2]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
HSD17B10 Q99714 3/20 0.52
LMNA P02545 2/20 0.52
KDM4E B2RXH2 2/20 0.52
PRNP P04156 1/20 0.52
HPGD P15428 1/20 0.52
MAPT P10636 2/20 0.50
PKM P14618 1/20 0.50
POLB P06746 3/20 0.41
PLA2G10 O15496 1/20 0.38
PLA2G2A P14555 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP3A4 P08684 1/20 0.38
PARP1 P09874 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL7140275 0.97 ALDH1A1 (0.54) ALDH1A1HSD17B10LMNAKDM4EPRNP
SCHEMBL3823636 0.87 TDP1 (0.50) ALDH1A1HSD17B10LMNAKDM4EPRNP
SCHEMBL9375831 0.85 ALDH1A1 (0.46) ALDH1A1HSD17B10LMNAKDM4EPRNP
SCHEMBL31210189 0.81
SCHEMBL26863630 0.81
SCHEMBL18913028 0.81 LMNA (0.43) ALDH1A1HSD17B10LMNAKDM4EPRNP
SCHEMBL14999641 0.79
SCHEMBL7152839 0.79
SCHEMBL4930089 0.79
SCHEMBL18547147 0.79

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
US-20100280186-A1 FURANIC-MODIFIED AMINE-BASED CURATIVES BATTELLE MEMORIAL INSTITUTE 2010-11-04 US claimed
US-20080207847-A1 Furanic-modified amine-based curatives BATTELLE MEMORIAL INSTITUTE 2008-08-28 US claimed
US-20100280186-A1 FURANIC-MODIFIED AMINE-BASED CURATIVES BATTELLE MEMORIAL INSTITUTE 2010-11-04 US disclosed
US-20080207847-A1 Furanic-modified amine-based curatives BATTELLE MEMORIAL INSTITUTE 2008-08-28 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-20100280186-A1 FURANIC-MODIFIED AMINE-BASED CURATIVES UMPS, SRM, PAM ALDH1A1 705/4885HSD17B10 2754/4885LMNA 2714/4885
US-20080207847-A1 Furanic-modified amine-based curatives DDC, AOC1, ESD ALDH1A1 428/4885HSD17B10 1560/4885LMNA 1319/4885

“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.