SCHEMBL17798767

SCHEMBL17798767

CCCCCCCCCCn1c(=O)c2cc3c(=O)n(CCCCCCN)c(=O)c3cc2c1=O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 9/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ DNM1 Q05193 6/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ TSHR P16473 1/20 0.45
▸ EPHX1 P07099 1/20 0.45
▸ RXRA P19793 2/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL10556725 0.91 TDP1 (0.58) TDP1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL10554618 0.91 TDP1 (0.58) TDP1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL18211041 0.89 TDP1 (0.56) TDP1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL18211042 0.89 TDP1 (0.56) TDP1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL25473109 0.86 TDP1 (0.53) TDP1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL12246385 0.86 TDP1 (0.53) TDP1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL13744749 0.86 TDP1 (0.53) TDP1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL24167474 0.84 TDP1 (0.44) TDP1ALDH1A1RXRA
SCHEMBL8777494 0.83 TDP1 (0.68) TDP1L3MBTL1ALDH1A1
SCHEMBL12895952 0.83 TDP1 (0.50) TDP1L3MBTL1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9803047-B2 Alternating ring-opening metathesis polymerization THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2017-10-31 — — US disclosed
US-20170158808-A1 ALTERNATING RING-OPENING METATHESIS POLYMERIZATION UNIV NEW YORK STATE RES FOUND (US) 2017-06-08 — — US disclosed
US-9624338-B2 Alternating ring-opening metathesis polymerization THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2017-04-18 — — US disclosed
US-20160159972-A1 ALTERNATING RING-OPENING METATHESIS POLYMERIZATION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-06-09 — — 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 (2 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-20170158808-A1 ALTERNATING RING-OPENING METATHESIS POLYMERIZATION PARG, PARN, TRPC4 TDP1 2937/4885L3MBTL1 2575/4885DNM1 96/4885
US-20160159972-A1 ALTERNATING RING-OPENING METATHESIS POLYMERIZATION PARG, PARN, TRPC4 TDP1 2937/4885L3MBTL1 2575/4885DNM1 96/4885

“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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