SCHEMBL10142007

SCHEMBL10142007

CCc1ncc2[nH]c(C)cc2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
HTT P42858 1/20 0.35
MAPT P10636 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
ATM Q13315 2/20 0.32
PSMD14 O00487 1/20 0.32
MMP2 P08253 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
VCP P55072 1/20 0.32
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
FABP6 P51161 1/20 0.31
CYP2A6 P11509 1/20 0.31
KEAP1 Q14145 1/20 0.31
KDM4E B2RXH2 2/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CACNA1B Q00975 1/20 0.30
APBA1 Q02410 1/20 0.30

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
SCHEMBL10142642 0.78 DHFR (0.35) GAAHTTLMNAKDM4EHSD17B10
SCHEMBL890167 0.77 NPY5R (0.37) HTTMAPTMEN1KMT2AATM
SCHEMBL29864056 0.74 TYRO3 (0.42) GAAHTTMAPTMEN1KMT2A
SCHEMBL13188450 0.74 FABP6 (0.32) MAPTMEN1KMT2AATMPSMD14
SCHEMBL12599033 0.71 NR3C1 (0.41) MAPTMEN1KMT2AATMLMNA
SCHEMBL12965833 0.69 FABP6 (0.45) GAAHTTMAPTMEN1KMT2A
SCHEMBL19362470 0.69 ADORA2A (0.39) KDM4EDDAH1
SCHEMBL15478309 0.69 VCP (0.40) GAAHTTVCP
SCHEMBL12942590 0.68 GAA (0.35) GAAHTTMAPTMEN1KMT2A
SCHEMBL15020994 0.66 CTSV (0.40) KMT2A

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-20120039848-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2012-02-16 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-20120039848-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 GAA 285/4885HTT 4444/4885MAPT 4133/4885

“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.