SCHEMBL10095249

SCHEMBL10095249

CCOC(=O)c1cn(CC)c2cc(OC)ccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.55
ALDH1A1 P00352 7/20 0.55
HPGD P15428 6/20 0.55
HSD17B10 Q99714 3/20 0.55
RAB9A P51151 2/20 0.55
TSHR P16473 1/20 0.55
LMNA P02545 2/20 0.53
NR4A2 P43354 1/20 0.52
POLB P06746 1/20 0.47
ATM Q13315 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
MAOB P27338 2/20 0.46
CA12 O43570 1/20 0.46
CA2 P00918 1/20 0.46
GLA P06280 1/20 0.46
CA3 P07451 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL980423 0.85 ALDH1A1 (0.59) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL980636 0.85 KDM4E (0.70) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL980705 0.84 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL10095260 0.84 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL10095268 0.82 ALDH1A1 (0.55) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL10095262 0.80 LMNA (0.58) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL2090257 0.79 NR4A2 (0.76) ALDH1A1TSHRLMNANR4A2POLB
SCHEMBL10095269 0.79 HDAC1 (0.54) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL983175 0.78 ALDH1A1 (0.51) KDM4EALDH1A1HPGDHSD17B10RAB9A
SCHEMBL14467734 0.78 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8927576-B2 HCV inhibitor and therapeutic agent combinations PTC Therpeutics, Inc. (US) 2015-01-06 US disclosed
US-8927576-B2 HCV inhibitor and therapeutic agent combinations PTC Therpeutics, Inc. (US) 2015-01-06 US disclosed
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations PTC THERAPEUTICS, INC. (US) 2012-02-02 US disclosed
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations PTC THERAPEUTICS, INC. (US) 2012-02-02 US disclosed
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-8013006-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-09-06 US disclosed
US-8013006-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-09-06 US disclosed
US-7868037-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-01-11 US disclosed
US-7868037-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-01-11 US disclosed
WO-2010118009-A1 HCV INHIBITOR AND THERAPEUTIC AGENT COMBINATIONS PTC THERAPEUTICS, INC. (US) 2010-10-14 WO disclosed
US-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus PTC THERAPEUTICS, INC. 2008-04-24 US disclosed
US-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus PTC THERAPEUTICS, INC. 2008-04-24 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 (3 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-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus EIF2AK2, INMT, IDO1 KDM4E 433/4885ALDH1A1 1556/4885HPGD 3067/4885
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C OAT, HAVCR2, HCCS KDM4E 3703/4885ALDH1A1 591/4885HPGD 1033/4885
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations HAVCR2, SERPINB1, ENPEP KDM4E 4208/4885ALDH1A1 1067/4885HPGD 1854/4885

“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.