SCHEMBL10240199

SCHEMBL10240199

Cc1c(C)c(N2CCN(c3ccc(C(C)C)cc3)CC2)c(C)c2c1OC(C)(C)C2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
PANK3 Q9H999 4/20 0.37
MAPK1 P28482 3/20 0.37
ALDH1A1 P00352 3/20 0.37
TP53 P04637 2/20 0.37
THRB P10828 1/20 0.37
GAA P10253 3/20 0.37
ALOX15 P16050 3/20 0.37
ALOX12 P18054 3/20 0.37
KDM4E B2RXH2 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 2/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
HRH3 Q9Y5N1 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP1A2 P05177 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
SCHEMBL661493 0.91 DPP4 (0.34) MAPTSMN1; SMN2PANK3MAPK1ALDH1A1
SCHEMBL657676 0.88 MEN1 (0.41) MAPTSMN1; SMN2ALDH1A1GAAKDM4E
SCHEMBL661032 0.87 AKR1C3 (0.40) MAPTSMN1; SMN2MAPK1ALDH1A1GAA
SCHEMBL660735 0.85 MAPT (0.36) MAPTSMN1; SMN2PANK3MAPK1ALDH1A1
SCHEMBL659624 0.85 LMNA (0.40) MAPTSMN1; SMN2MAPK1ALDH1A1TP53
SCHEMBL658656 0.84 LMNA (0.34) MAPTSMN1; SMN2ALDH1A1GAAKDM4E
SCHEMBL659127 0.83 MAPT (0.39) MAPTSMN1; SMN2MAPK1ALDH1A1GAA
SCHEMBL658597 0.83 DRD2 (0.46) MAPTALDH1A1GAAL3MBTL1LMNA
SCHEMBL657755 0.83 HSP90AA1 (0.32) MEN1KMT2A
SCHEMBL659366 0.82 ALDH1A1 (0.32) SMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046277-A1 BENZOFURAN DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-02-23 US disclosed
US-20120046277-A1 BENZOFURAN DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-02-23 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-20120046277-A1 BENZOFURAN DERIVATIVES BRPF3, BRD1, CBR3 MAPT 4353/4885SMN1; SMN2 2862/4885PANK3 1963/4885

“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.