SCHEMBL17833966

SCHEMBL17833966

Cc1ccc(Sc2ccc(/C=C3\SC(=O)N(C(C)C)C3=O)o2)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MYC P01106 16/20 0.64
MAPT P10636 4/20 0.59
ALDH1A1 P00352 3/20 0.59
MEN1 O00255 3/20 0.59
MAPK1 P28482 3/20 0.59
KMT2A Q03164 3/20 0.59
LMNA P02545 2/20 0.59
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
NPSR1 Q6W5P4 2/20 0.55
GFER P55789 1/20 0.55
PKM P14618 2/20 0.55
TDP1 Q9NUW8 1/20 0.55

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
SCHEMBL17833968 0.79 KMT2A (0.65) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17834250 0.79 MYC (0.82) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17821352 0.78 MYC (1.00) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17821351 0.78 MYC (1.00) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17821346 0.78 MYC (1.00) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17821347 0.78 MYC (1.00) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17821389 0.76 MYC (1.00) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17821391 0.76 MYC (1.00) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17821393 0.75 MYC (1.00) MYCMAPTALDH1A1MEN1MAPK1
SCHEMBL17821395 0.75 MYC (1.00) MYCMAPTALDH1A1MEN1MAPK1

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-20200048276-A9 MYC MODULATORS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-02-13 US disclosed
US-10017520-B2 Myc modulators and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2018-07-10 US disclosed
US-10017520-B2 Myc modulators and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2018-07-10 US disclosed
US-20160168165-A1 MYC MODULATORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-16 US disclosed
US-20160168165-A1 MYC MODULATORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-16 US disclosed
WO-2016094688-A1 FUSED 1,3-AZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-06-16 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 (3 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-20160168165-A1 MYC MODULATORS AND USES THEREOF MYC, MYCBP, MYCBP2 MYC 1/4885MAPT 2226/4885ALDH1A1 2650/4885
US-20200048276-A9 MYC MODULATORS AND USES THEREOF MYC, MYCBP, MYCBP2 MYC 1/4885MAPT 2226/4885ALDH1A1 2650/4885
US-10017520-B2 Myc modulators and uses thereof MYC, MYCBP, MYCBP2 MYC 1/4885MAPT 2226/4885ALDH1A1 2650/4885

“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.