SCHEMBL23249333

SCHEMBL23249333

CCc1c(C)nc(NN)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ LMNA P02545 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ MAPT P10636 5/20 0.43
▸ HTT P42858 4/20 0.43
▸ NPSR1 Q6W5P4 4/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ XBP1 P17861 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ ALOX15 P16050 1/20 0.40
▸ GLA P06280 1/20 0.39

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
SCHEMBL18689562 0.77 GAA (0.48) KMT2ALMNAALDH1A1RAB9ATSHR
SCHEMBL5935686 0.73 TP53 (0.53) KMT2AMEN1LMNAHSD17B10TSHR
SCHEMBL10857521 0.69 KDM4E (0.63) LMNAALDH1A1TSHRMAPTHTT
Ethirimol SCHEMBL10391126 0.68 HTT (0.61) KMT2AMEN1LMNAALDH1A1HSD17B10
SCHEMBL11875668 0.68 — —
SCHEMBL844148 0.67 LMNA (0.53) KMT2ALMNAMAPTSMN1; SMN2NPC1
SCHEMBL11623611 0.67 SMN1; SMN2 (0.49) KMT2AMEN1LMNAALDH1A1HSD17B10
SCHEMBL9490757 0.67 KDM4E (0.50) KMT2AMEN1LMNAALDH1A1HSD17B10
SCHEMBL9382400 0.66 KMT2A (0.45) KMT2AMEN1LMNAALDH1A1HSD17B10
SCHEMBL9382139 0.65 HTT (0.51) KMT2AMEN1LMNAALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240139190-A1 NOVEL ANTIPARASITIC COMPOUNDS AND METHODS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2024-05-02 — — US disclosed
WO-2021077102-A1 NOVEL ANTIPARASITIC COMPOUNDS AND METHODS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-04-22 — — WO disclosed
WO-2021077102-A1 NOVEL ANTIPARASITIC COMPOUNDS AND METHODS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-04-22 — — 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-20240139190-A1 NOVEL ANTIPARASITIC COMPOUNDS AND METHODS TUBB, TUBB1, TUBA1C KMT2A 2334/4885MEN1 4505/4885LMNA 1503/4885

“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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