SCHEMBL4024692

SCHEMBL4024692

O=C(C=Cc1ccco1)Nc1ccccc1C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 12/20 1.00
MEN1 O00255 10/20 1.00
RAB9A P51151 9/20 1.00
NPC1 O15118 8/20 1.00
MAPT P10636 7/20 1.00
POLB P06746 7/20 1.00
L3MBTL1 Q9Y468 5/20 1.00
SMN1; SMN2 Q16637 5/20 1.00
TDP1 Q9NUW8 4/20 1.00
RECQL P46063 3/20 1.00
KDM4E B2RXH2 3/20 1.00
APEX1 P27695 1/20 1.00
ALDH1A1 P00352 4/20 0.74
THRB P10828 1/20 0.74
HPGD P15428 1/20 0.71
GAA P10253 2/20 0.60
TRPM2 O94759 1/20 0.59
LTB4R Q15722 1/20 0.59
TRPA1 O75762 4/20 0.58
TRPM8 Q7Z2W7 2/20 0.58

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
SCHEMBL4024688 1.00 KMT2A (1.00) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL10981054 0.85 ALDH1A1 (1.00) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL6541748 0.85 KMT2A (0.74) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL6541745 0.85 KMT2A (0.74) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL13854024 0.85 KMT2A (0.74) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL9767814 0.81 ALDH1A1 (0.78) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL31530581 0.81 RAB9A (0.77) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL31530568 0.81 RAB9A (0.77) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL6037174 0.80 KMT2A (0.66) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL6037177 0.80 KMT2A (0.66) KMT2AMEN1RAB9ANPC1MAPT

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
US-20110054034-A1 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS GRAND VALLEY STATE UNIVERSITY 2011-03-03 US claimed
WO-2009100323-A2 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS GRAND VALLEY STATE UNIVERSITY (US) 2009-08-13 WO claimed
US-20110054034-A1 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS GRAND VALLEY STATE UNIVERSITY 2011-03-03 US disclosed
WO-2009100323-A2 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS GRAND VALLEY STATE UNIVERSITY (US) 2009-08-13 WO disclosed
US-5006548-A Hyaluronidase inhibitors, antiallergens, immunomodulators SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-04-09 US disclosed
EP-0153850-B1 ACRYLAMIDOBENZOIC ACID DERIVATIVES AND THEIR USE SAWAI PHARMACEUTICAL CO., LTD. (JP) 1989-09-13 EP 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-20110054034-A1 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS NAAA, ELANE, APEH KMT2A 1670/4885MEN1 3484/4885RAB9A 1107/4885

“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.