SCHEMBL22601219

SCHEMBL22601219

Cc1ccc(N2CCN(C(=O)Nc3ccc(O)cc3)CC2)nc1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PANK3 Q9H999 8/20 0.77
KDM4E B2RXH2 4/20 0.65
MAPT P10636 3/20 0.65
ALDH1A1 P00352 2/20 0.65
CA12 O43570 4/20 0.58
CA2 P00918 4/20 0.58
CA9 Q16790 4/20 0.58
CA1 P00915 3/20 0.58
P2RY12 Q9H244 1/20 0.55
LMNA P02545 1/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MAPK1 P28482 1/20 0.54
TRPV1 Q8NER1 2/20 0.53
PKM P14618 1/20 0.53

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
SCHEMBL26502492 0.94 PANK3 (0.82) PANK3KDM4EMAPTALDH1A1P2RY12
SCHEMBL26502500 0.89 PANK3 (0.79) PANK3KDM4EMAPTALDH1A1CA12
SCHEMBL26502501 0.89 PANK3 (0.75) PANK3KDM4EMAPTALDH1A1P2RY12
SCHEMBL13115802 0.89 PANK3 (0.74) PANK3KDM4EMAPTALDH1A1P2RY12
SCHEMBL26502503 0.88 PANK3 (0.73) PANK3KDM4EMAPTALDH1A1P2RY12
SCHEMBL26502512 0.87 PANK3 (0.72) PANK3KDM4EMAPTALDH1A1P2RY12
SCHEMBL26502506 0.87 PANK3 (0.72) PANK3KDM4EMAPTALDH1A1CA12
SCHEMBL26502504 0.87 PANK3 (0.72) PANK3KDM4EMAPTALDH1A1CA12
SCHEMBL19748515 0.87 PANK3 (1.00) PANK3KDM4EMAPTALDH1A1TRPV1
SCHEMBL26501862 0.87 PANK3 (0.73) PANK3KDM4EMAPTALDH1A1CA12

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-20230357187-A1 Inhibitors of Dihydroceramide Desaturase For Treating Disease CENTAURUS THERAPEUTICS 2023-11-09 US disclosed
US-20230357187-A1 Inhibitors of Dihydroceramide Desaturase For Treating Disease CENTAURUS THERAPEUTICS 2023-11-09 US disclosed
US-11597715-B2 Inhibitors of dihydroceramide desaturase for treating disease CENTAURUS THERAPEUTICS (US) 2023-03-07 US disclosed
US-20200339535-A1 Inhibitors of Dihydroceramide Desaturase For Treating Disease CENTAURUS THERAPEUTICS 2020-10-29 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 (3 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-11597715-B2 Inhibitors of dihydroceramide desaturase for treating disease CERS2, SMPD1, ASAH1 PANK3 2135/4885KDM4E 3704/4885MAPT 2085/4885
US-20200339535-A1 Inhibitors of Dihydroceramide Desaturase For Treating Disease CERS2, SMPD1, ASAH1 PANK3 2135/4885KDM4E 3704/4885MAPT 2085/4885
US-20230357187-A1 Inhibitors of Dihydroceramide Desaturase For Treating Disease CERS2, SMPD1, ASAH1 PANK3 2135/4885KDM4E 3704/4885MAPT 2085/4885

“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.