SCHEMBL17356365

SCHEMBL17356365

CC/C=C/c1cc(CO)ccc1N

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SLC6A2 P23975 5/20 0.32
▸ SLC6A4 P31645 5/20 0.32
▸ SLC6A3 Q01959 2/20 0.32
▸ SKP2 Q13309 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ NOS3 P29474 1/20 0.30
▸ NOS1 P29475 1/20 0.30

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
SCHEMBL14148803 0.86 EGFR (0.40) EGFRKDM4EMEN1POLBGAA
SCHEMBL4731185 0.79 EGFR (0.45) EGFRKDM4EMEN1POLBGAA
SCHEMBL20203376 0.77 ALDH1A1 (0.55) KDM4EGAAMAPTALDH1A1
SCHEMBL17071910 0.77 SMN1; SMN2 (0.45) GAAMAPTRAB9AALDH1A1
SCHEMBL14148734 0.75 IAPP (0.48) EGFR
SCHEMBL14148738 0.75 EGFR (0.69) EGFRALDH1A1
SCHEMBL18556990 0.74 EGFR (0.31) EGFR
SCHEMBL14148802 0.74 TTR (0.46) EGFR
SCHEMBL26522130 0.73 CYP1A1 (0.43) MEN1POLBMAPTRAB9AKMT2A
SCHEMBL14148735 0.70 EGFR (0.43) EGFRKDM4EGAAMAPTSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580553-B2 Thermally-activated self-immolative materials UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2017-02-28 — — US disclosed
US-20150368403-A1 THERMALLY-ACTIVATED SELF-IMMOLATIVE MATERIALS UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2015-12-24 — — 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-20150368403-A1 THERMALLY-ACTIVATED SELF-IMMOLATIVE MATERIALS PARG, PAICS, LRBA EGFR 3270/4885KDM4E 4706/4885MEN1 2191/4885

“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.

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