SCHEMBL15714768

SCHEMBL15714768

CCCOC(=O)c1ccc(-n2c(CCC(=O)O)ccc2-c2ccccc2)cc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MYC P01106 2/20 1.00
MAPT P10636 9/20 0.85
ALDH1A1 P00352 4/20 0.57
KDM4E B2RXH2 4/20 0.57
ALOX15 P16050 1/20 0.57
ALOX12 P18054 1/20 0.57
MAPK1 P28482 1/20 0.57
HSD17B10 Q99714 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
POLB P06746 5/20 0.54
TP53 P04637 2/20 0.53
THRB P10828 1/20 0.53
HTT P42858 1/20 0.51

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
SCHEMBL15714467 0.92 MAPT (1.00) MYCMAPTALDH1A1KDM4EALOX15
SCHEMBL15714466 0.83 MYC (1.00) MYCMAPTALDH1A1KDM4EALOX15
SCHEMBL15714452 0.82 MAPT (0.82) MYCMAPTALDH1A1KDM4EALOX15
SCHEMBL15714458 0.80 MAPT (0.74) MYCMAPTALDH1A1KDM4EALOX15
SCHEMBL245147 0.79 MAPT (0.68) MYCMAPTALDH1A1KDM4EALOX15
SCHEMBL245490 0.77 MAPT (0.68) MYCMAPTALDH1A1KDM4EALOX15
SCHEMBL245472 0.75 MAPT (0.70) MYCMAPTALDH1A1KDM4EALOX15
SCHEMBL246344 0.74 MAPT (0.67) MYCMAPTALDH1A1KDM4EALOX15
SCHEMBL9763027 0.74 MEN1 (0.81) MAPTALDH1A1KDM4EALOX15ALOX12
SCHEMBL14865047 0.72 MAPT (1.00) MAPTALDH1A1KDM4EALOX15ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2917203-B1 METHOD FOR IDENTIFYING MYC INHIBITORS DANA FARBER CANCER INST INC (US) 2019-04-03 EP disclosed
US-9567301-B2 Pyrrol-1-yl benzoic acid derivatives useful as myc inhibitors DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-02-14 US disclosed
US-9567301-B2 Pyrrol-1-yl benzoic acid derivatives useful as myc inhibitors DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-02-14 US disclosed
US-9540320-B2 2017-01-10 US disclosed
US-9540320-B2 2017-01-10 US disclosed
US-20150291521-A1 PYRROL-1-YL BENZOIC ACID DERIVATIVES USEFUL AS MYC INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. 2015-10-15 US disclosed
US-20150291521-A1 PYRROL-1-YL BENZOIC ACID DERIVATIVES USEFUL AS MYC INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. 2015-10-15 US disclosed
WO-2014071247-A1 PYRROL-1 -YL BENZOIC ACID DERIVATES USEFUL AS MYC INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2014-05-08 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-20150291521-A1 PYRROL-1-YL BENZOIC ACID DERIVATIVES USEFUL AS MYC INHIBITORS MYC, MYCBP, YAP1 MYC 1/4885MAPT 2353/4885ALDH1A1 963/4885

“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.