SCHEMBL24590133

SCHEMBL24590133

CC(C)(C)Nc1ccc(N2CCOCC2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.54
▸ GAA P10253 3/20 0.54
▸ CYP1A2 P05177 3/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ STAT3 P40763 1/20 0.52
▸ ALDH1A1 P00352 4/20 0.51
▸ LMNA P02545 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ HTT P42858 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ RECQL P46063 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ RAB9A P51151 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ KCNQ3 O43525 1/20 0.48
▸ KCNQ2 O43526 1/20 0.48

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
SCHEMBL8254604 0.86 TRPV1 (0.46) MAPTGAACYP1A2MEN1KMT2A
SCHEMBL8260664 0.84 TRPV1 (0.48) MAPTGAAALDH1A1LMNAKDM4E
SCHEMBL13761492 0.83 RAB9A (0.53) MAPTGAAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL2790485 0.83 MAPT (0.58) MAPTGAACYP1A2MEN1KMT2A
SCHEMBL21917393 0.82 MAPT (0.54) MAPTGAACYP1A2MEN1KMT2A
SCHEMBL15179045 0.81 KDM4E (0.50) MAPTGAASMN1; SMN2ALDH1A1KDM4E
SCHEMBL24590359 0.80 POLB (0.49) MAPTGAACYP1A2KMT2ACYP2C19
SCHEMBL16864479 0.80 MAPT (0.54) MAPTGAACYP1A2MEN1KMT2A
SCHEMBL1399272 0.79 MAPT (0.68) MAPTGAACYP1A2MEN1KMT2A
SCHEMBL13034793 0.79 MAPT (0.54) MAPTGAACYP1A2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220204497-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME DONGGUK UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2022-06-30 — — 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-20220204497-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME TPX2, AIMP2, CDYL2 MAPT 4461/4885GAA 798/4885CYP1A2 1120/4885

“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.

Send feedback