SCHEMBL3478864

SCHEMBL3478864

CCc1nc(-c2nc(C(C)C)cs2)nc2c(C)c(OC)ccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.34
KDM4E B2RXH2 5/20 0.34
MAPT P10636 3/20 0.34
TDP1 Q9NUW8 1/20 0.33
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
APLNR P35414 4/20 0.32
HSD17B10 Q99714 1/20 0.31
SLC10A2 Q12908 1/20 0.30
LMNA P02545 1/20 0.30
PPARG P37231 1/20 0.30
GFER P55789 1/20 0.30
NCOA2 Q15596 1/20 0.30
NCOA1 Q15788 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
CTSS P25774 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
SCHEMBL1496441 0.85 ALDH1A1 (0.33) ALDH1A1KDM4EMAPTTDP1MAPK1
SCHEMBL882975 0.85 ALDH1A1 (0.33) ALDH1A1KDM4ETDP1APLNRCTSS
SCHEMBL3429563 0.84 KDM4E (0.31) ALDH1A1KDM4ETDP1APLNRCTSS
SCHEMBL8004421 0.84 ADORA2A (0.39) ALDH1A1KDM4EMAPTTDP1APLNR
SCHEMBL1496428 0.84 APLNR (0.35) ALDH1A1KDM4EMAPTTDP1SMN1; SMN2
SCHEMBL15216093 0.84 ALDH1A1 (0.32) ALDH1A1KDM4ETDP1APLNRCTSS
SCHEMBL3429859 0.82 MAPT (0.35) ALDH1A1KDM4EMAPTTDP1APLNR
SCHEMBL3478924 0.80 KDM4E (0.39) ALDH1A1KDM4EMAPTTDP1MAPK1
SCHEMBL10265556 0.79 CTSS (0.37) ALDH1A1KDM4EMAPTTDP1SMN1; SMN2
SCHEMBL7944203 0.77 CTSS (0.40) ALDH1A1KDM4EMAPTTDP1SMN1; SMN2

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-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-04-19 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-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION VIP, EIF2AK2, PREP ALDH1A1 1706/4885KDM4E 695/4885MAPT 4366/4885

“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.