SCHEMBL30788969

SCHEMBL30788969

COC(=O)CC(C)(C)n1cc(-c2ccccc2)nn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 1/20 0.43
▸ HDAC3 O15379 6/20 0.41
▸ HDAC4 P56524 6/20 0.41
▸ HDAC1 Q13547 6/20 0.41
▸ HDAC7 Q8WUI4 6/20 0.41
▸ HDAC2 Q92769 6/20 0.41
▸ HDAC10 Q969S8 6/20 0.41
▸ HDAC11 Q96DB2 6/20 0.41
▸ HDAC8 Q9BY41 6/20 0.41
▸ HDAC6 Q9UBN7 6/20 0.41
▸ HDAC9 Q9UKV0 6/20 0.41
▸ HDAC5 Q9UQL6 6/20 0.41
▸ POLB P06746 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ EGLN1 Q9GZT9 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ OGT O15294 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPC1 O15118 1/20 0.40

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
SCHEMBL22821490 0.77 CYP19A1 (0.46) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL32670361 0.76 CYP19A1 (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL22959003 0.75 SRC (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL32670642 0.74 SMN1; SMN2 (0.43) POLBSMN1; SMN2CNR2MEN1KMT2A
SCHEMBL13036563 0.73 CYP19A1 (0.47) OGTKMT2ANPC1RAB9AGGPS1
SCHEMBL22530277 0.73 NLRP3 (0.47) SRC
SCHEMBL30788869 0.73 PTGS2 (0.43) MEN1KMT2ANPC1RAB9ACASP3
SCHEMBL22530265 0.72 NLRP3 (0.47) SRC
SCHEMBL26156421 0.70 CYP19A1 (0.45) SMN1; SMN2OGTNPC1RAB9ASRC
SCHEMBL20995389 0.70 CYP19A1 (0.47) MEN1KMT2ANPC1RAB9ACASP3

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-20260034094-A1 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS KOJIN THERAPEUTICS INC (US) 2026-02-05 — — US disclosed
EP-4565228-A2 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS Kojin Therapeutics, Inc. (US) 2025-06-11 — — EP disclosed
WO-2024030960-A2 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS Kojin Therapeutics, Inc. (US) 2024-02-08 — — 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-20260034094-A1 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS AIFM2, GPX4, HMOX1 XDH 1891/4885HDAC3 620/4885HDAC4 1576/4885

“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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