SCHEMBL4168669

SCHEMBL4168669

CCOC(=O)c1cc2cccc(-c3ccccc3C)c2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.59
KDM4E B2RXH2 4/20 0.59
ALDH1A1 P00352 4/20 0.59
HPGD P15428 4/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
NPC1 O15118 2/20 0.59
LMNA P02545 2/20 0.59
MAPT P10636 2/20 0.59
MEN1 O00255 1/20 0.59
GLA P06280 1/20 0.59
GAA P10253 1/20 0.59
KMT2A Q03164 1/20 0.59
ATM Q13315 1/20 0.59
CDK1 P06493 1/20 0.55
CCNB1 P14635 1/20 0.55
HSD17B10 Q99714 2/20 0.50
ALOX15 P16050 1/20 0.48
NSD2 O96028 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL31501839 0.89 KDM4E (0.61) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL4040141 0.89 KDM4E (0.61) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL7878075 0.88 KDM4E (0.61) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL23167606 0.82 KDM4E (0.54) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL24455364 0.82 CDK1 (0.48) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL30555051 0.82 CDK1 (0.48) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL4045458 0.82 RAB9A (0.59) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL10506586 0.82 ALDH1A1 (0.59) RAB9AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL29053642 0.81 HSD17B10 (0.58) KDM4EALDH1A1HPGDLMNAMAPT
SCHEMBL30494310 0.81 HSD17B10 (0.58) KDM4EALDH1A1HPGDLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3243814-B1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS ABBVIE INC (US) 2018-10-17 EP disclosed
EP-3243814-A1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS AbbVie Inc. (US) 2017-11-15 EP disclosed
EP-2134684-B1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS ABBVIE INC (US) 2017-08-02 EP disclosed
US-9359296-B2 7-substituted indole Mcl-1 inhibitors ABBVIE INC. (US) 2016-06-07 US disclosed
US-20150284328-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBVIE INC (US) 2015-10-08 US disclosed
US-9035047-B2 7-substituted indole Mcl-1 inhibitors ABBVIE INC. (US) 2015-05-19 US disclosed
US-20140051683-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBVIE INC. (US) 2014-02-20 US disclosed
US-8445679-B2 7-substituted indole MCL-1 inhibitors ABBVIE INC. (US) 2013-05-21 US disclosed
EP-2134684-A2 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS Abbott Laboratories (US) 2009-12-23 EP disclosed
US-20090054402-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBOTT LABORATORIES (US) 2009-02-26 US disclosed
WO-2008131000-A2 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBOTT LABORATORIES (US) 2008-10-30 WO 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-20140051683-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 RAB9A 2895/4885KDM4E 2331/4885ALDH1A1 2525/4885
US-20150284328-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 RAB9A 2895/4885KDM4E 2331/4885ALDH1A1 2525/4885
US-20090054402-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 RAB9A 2895/4885KDM4E 2331/4885ALDH1A1 2525/4885

“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.