SCHEMBL5281301

SCHEMBL5281301

NC(Cc1cn(Cl)c2ccccc12)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.67
ALDH1A1 P00352 2/20 0.67
RECQL P46063 2/20 0.67
PTGS2 P35354 1/20 0.53
SCN9A Q15858 1/20 0.51
KMT2A Q03164 3/20 0.50
KDM4E B2RXH2 3/20 0.50
MEN1 O00255 2/20 0.50
LMNA P02545 2/20 0.50
BLM P54132 2/20 0.50
PMP22 Q01453 2/20 0.50
HIF1A Q16665 2/20 0.50
MPO P05164 1/20 0.50
TSHR P16473 1/20 0.50
NOS3 P29474 3/20 0.48
NOS1 P29475 3/20 0.48
NOS2 P35228 3/20 0.48
PKM P14618 2/20 0.47
ALPI P09923 1/20 0.47
PTGS1 P23219 1/20 0.47

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
SCHEMBL1059011 1.00 MAPT (0.67) MAPTALDH1A1RECQLPTGS2SCN9A
SCHEMBL128686 1.00 MAPT (0.67) MAPTALDH1A1RECQLPTGS2SCN9A
SCHEMBL16281039 0.87 MAPT (0.68) MAPTALDH1A1RECQLPTGS2SCN9A
SCHEMBL29982985 0.84 ALDH1A1 (0.65) MAPTALDH1A1RECQLPTGS2SCN9A
SCHEMBL1079739 0.84 MAPT (0.68) MAPTALDH1A1RECQLPTGS2SCN9A
SCHEMBL1079740 0.84 MAPT (0.68) MAPTALDH1A1RECQLPTGS2SCN9A
SCHEMBL11033128 0.83 KMT2A (0.69) MAPTALDH1A1RECQLKMT2ALMNA
SCHEMBL9584445 0.83 KMT2A (0.69) MAPTALDH1A1RECQLKMT2ALMNA
SCHEMBL24213670 0.82 MAPT (0.67) MAPTALDH1A1RECQLPTGS2SCN9A
SCHEMBL20038781 0.82 MAPT (0.67) MAPTALDH1A1RECQLPTGS2SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007002594-A1 COSMETIC COMPOSITIONS AND METHODS USING TRANSFORMING GROWTH FACTOR-BETA MIMICS BHATNAGAR RAJENDRA S (US) 2007-01-04 WO disclosed
WO-2007002469-A2 THERAPEUTIC COMPOSITIONS AND METHODS USING TRANSFORMING GROWTH FACTOR-BETA MIMICS BHATNAGAR RAJENDRA S (US) 2007-01-04 WO disclosed
US-20060293227-A1 Cosmetic compositions and methods using transforming growth factor-beta mimics BHATNAGAR RAJENDRA S 2006-12-28 US disclosed
US-20060293228-A1 Therapeutic compositions and methods using transforming growth factor-beta mimics BHATNAGAR RAJENDRA S 2006-12-28 US disclosed
US-6774212-B2 FOR THERAPY OF VIRAL INFECTION OR AS AN ASSAY STANDARD OR REAGENT BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-08-10 US disclosed
US-20020123468-A1 Alpha-ketoamide inhibitors of hepatitis C virus NS3 protease BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-09-05 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-20020123468-A1 Alpha-ketoamide inhibitors of hepatitis C virus NS3 protease CES1, CYP51A1, SPINT2 MAPT 3370/4885ALDH1A1 697/4885RECQL 3831/4885

“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.