SCHEMBL12995242

SCHEMBL12995242

CCOc1ccc2c(C(=O)NC3CC3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
MAPT P10636 6/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 2/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
MAPK1 P28482 1/20 0.36
HTR3A P46098 2/20 0.36
BCHE P06276 1/20 0.35
CNR2 P34972 1/20 0.35
OPRK1 P41145 1/20 0.35

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
SCHEMBL12995076 0.95 MEN1 (0.41) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL10096109 0.90 MEN1 (0.38) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL12995240 0.90 MEN1 (0.38) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL12995372 0.88 RAB9A (0.53) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL12995243 0.87 S1PR3 (0.38) HTR3A
SCHEMBL12995219 0.87 KMT2A (0.39) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL12995267 0.87 MEN1 (0.39) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL10096103 0.87 POLB (0.37) MEN1KMT2AMAPTGAAHPGD
SCHEMBL14467126 0.86 MEN1 (0.39) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL10097435 0.86 MEN1 (0.38) MEN1KMT2AMAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-7772271-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-7772271-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2010-08-10 US disclosed
US-20070299068-A1 Methods for treating hepatitis C PTC THERAPEUTICS, INC. 2007-12-27 US disclosed
US-20070299068-A1 Methods for treating hepatitis C PTC THERAPEUTICS, INC. 2007-12-27 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 (2 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-20070299068-A1 Methods for treating hepatitis C HAVCR2, EIF2AK2, MAVS MEN1 4800/4885KMT2A 4464/4885MAPT 4477/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS MEN1 4800/4885KMT2A 4464/4885MAPT 4477/4885

“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.