SCHEMBL30330226

SCHEMBL30330226

CNc1cc(C)nc(Nc2cc(OCCCCl)c3c(c2)OCO3)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EPHB4 P54760 3/20 0.35
▸ DHFR P00374 1/20 0.34
▸ EHMT2 Q96KQ7 1/20 0.34
▸ EHMT1 Q9H9B1 1/20 0.34
▸ KCNH2 Q12809 1/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31

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
SCHEMBL25166694 1.00 EPHB4 (0.35) EPHB4DHFREHMT2EHMT1KCNH2
SCHEMBL25166249 0.86 EHMT2 (0.50) EPHB4EHMT2EHMT1KCNH2
SCHEMBL30330206 0.86 EHMT2 (0.50) EPHB4EHMT2EHMT1KCNH2
SCHEMBL30329704 0.78 NPC1 (0.38) KCNH2SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL25166455 0.78 NPC1 (0.38) KCNH2SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL30330176 0.77 NPC1 (0.32) EPHB4KCNH2SMN1; SMN2NPC1RAB9A
SCHEMBL30330007 0.77 NPC1 (0.32) EPHB4KCNH2SMN1; SMN2NPC1RAB9A
SCHEMBL25165926 0.73 EHMT2 (0.67) EPHB4EHMT2EHMT1KCNH2
SCHEMBL30329803 0.73 EHMT2 (0.67) EPHB4EHMT2EHMT1KCNH2
SCHEMBL30329678 0.69 ABCB1 (0.36) SMN1; SMN2KMT2AALDH1A1MAPTHTT

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-20240368139-A1 NOVEL MODULATORS OF EHMT1 AND EHMT2 AND THERAPEUTIC USE THEREOF TANGO THERAPEUTICS, INC. 2024-11-07 — — US disclosed
CN-118647610-A Novel modulators of EHMT1 and EHMT2 and therapeutic uses thereof 探戈医药股份有限公司 2024-09-13 — — CN disclosed
EP-4416143-A1 NOVEL MODULATORS OF EHMT1 AND EHMT2 AND THERAPEUTIC USE THEREOF Tango Therapeutics, Inc. (US) 2024-08-21 — — EP disclosed
WO-2023064586-A1 NOVEL MODULATORS OF EHMT1 AND EHMT2 AND THERAPEUTIC USE THEREOF TANGO THERAPEUTICS, INC. (US) 2023-04-20 — — 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-20240368139-A1 NOVEL MODULATORS OF EHMT1 AND EHMT2 AND THERAPEUTIC USE THEREOF EHMT1, EHMT2, SHMT1 EPHB4 678/4885DHFR 417/4885EHMT2 2/4885

“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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