SCHEMBL2220909

SCHEMBL2220909

NC(=O)c1oc2cccnc2c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.46
PARP1 P09874 1/20 0.44
KDM4E B2RXH2 5/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
ALDH1A1 P00352 2/20 0.43
IKBKB O14920 1/20 0.40
CHUK O15111 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
MKNK2 Q9HBH9 2/20 0.37
MKNK1 Q9BUB5 1/20 0.37
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
PLK4 O00444 1/20 0.37
MAP4K4 O95819 1/20 0.37
EGFR P00533 1/20 0.37
ROS1 P08922 1/20 0.37

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
SCHEMBL13624583 0.85 BRD4 (0.40) LIMK1PARP1KDM4EHPGDHSD17B10
SCHEMBL2950634 0.81 KDM4E (0.60) KDM4EHPGDHSD17B10ALDH1A1L3MBTL1
SCHEMBL13925859 0.78 KDM4E (0.40) LIMK1PARP1KDM4EHPGDHSD17B10
SCHEMBL19587047 0.74 LMNA (0.46) LIMK1KDM4EHSD17B10ALDH1A1L3MBTL1
SCHEMBL2946788 0.72 SMN1; SMN2 (0.58) KDM4EHPGDALDH1A1L3MBTL1TSHR
SCHEMBL1006030 0.72 MAPT (0.67) KDM4EHPGDHSD17B10ALDH1A1TSHR
SCHEMBL222309 0.71 DDR2 (0.50) KDM4EHPGDHSD17B10L3MBTL1RAB9A
SCHEMBL9693742 0.71 TSHR (0.45) KDM4EHPGDHSD17B10ALDH1A1L3MBTL1
SCHEMBL31437376 0.71 LIMK1 (0.41) LIMK1PARP1KDM4EALDH1A1IKBKB
SCHEMBL26674702 0.71 LIMK1 (0.41) LIMK1PARP1KDM4EALDH1A1IKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110178107-A1 HCV PROTEASE INHIBITORS TAIGEN BIOTECHNOLOGY CO., LTD. (TW) 2011-07-21 US disclosed
US-20110178107-A1 HCV PROTEASE INHIBITORS TAIGEN BIOTECHNOLOGY CO., LTD. (TW) 2011-07-21 US disclosed
US-20110178107-A1 HCV PROTEASE INHIBITORS TAIGEN BIOTECHNOLOGY CO., LTD. (TW) 2011-07-21 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-20110178107-A1 HCV PROTEASE INHIBITORS HAVCR2, RNASE1, SERPINB1 LIMK1 4142/4885PARP1 3938/4885KDM4E 2187/4885

“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.