SCHEMBL2603393

SCHEMBL2603393

COC(=O)CCCCOc1ccc(C(=O)CN)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
L3MBTL1 Q9Y468 3/20 0.51
MMP1 P03956 1/20 0.49
GAA P10253 1/20 0.49
THRA P10827 3/20 0.47
THRB P10828 3/20 0.47
NPC1 O15118 1/20 0.46
PPARA Q07869 1/20 0.46
HTT P42858 1/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
P2RY12 Q9H244 1/20 0.44
LTA4H P09960 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL2603391 0.85 GSK3B (0.57) MAPTL3MBTL1MMP1GAATHRA
SCHEMBL4275826 0.84 HDAC1 (0.56) MAPTL3MBTL1GAAHTTPDE3B
SCHEMBL28698021 0.84 GSK3B (0.55) MAPTL3MBTL1MMP1GAATHRA
SCHEMBL28693965 0.84 GSK3B (0.55) MAPTL3MBTL1MMP1GAATHRA
SCHEMBL28685533 0.84 GSK3B (0.55) MAPTL3MBTL1MMP1GAATHRA
SCHEMBL4211416 0.83 TSHR (0.64) L3MBTL1HTTTP53TSHR
SCHEMBL5187570 0.83 MAPT (0.72) MAPTL3MBTL1GAANPC1PPARA
SCHEMBL2603390 0.83 L3MBTL1 (0.74) MAPTL3MBTL1GAAPPARAHTT
SCHEMBL10106958 0.83 MAPT (0.54) MAPTL3MBTL1MMP1GAATHRA
SCHEMBL9329263 0.82 TSHR (0.67) GAAHTTTP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9644099-B2 Violet laser excitable dyes and their method of use Life Technologies Corporation (US) 2017-05-09 US disclosed
US-9644099-B2 Violet laser excitable dyes and their method of use Life Technologies Corporation (US) 2017-05-09 US disclosed
US-20160355682-A1 VIOLET LASER EXCITABLE DYES AND THEIR METHOD OF USE Life Technologies Corporation 2016-12-08 US disclosed
US-20150050685-A1 VIOLET LASER EXCITABLE DYES AND THEIR METHOD OF USE LIFE TECHNOLOGIES CORP (US) 2015-02-19 US disclosed
US-8822695-B2 Violet laser excitable dyes and their method of use Life Technologies Corporation (US) 2014-09-02 US disclosed
US-20130273569-A1 VIOLET LASER EXCITABLE DYES AND THEIR METHOD OF USE LIFE TECHNOLOGIES CORP (US) 2013-10-17 US disclosed
US-8415477-B2 Violet laser excitable dyes and their method of use Life Technologies Corporation (US) 2013-04-09 US disclosed
US-8158801-B2 Violet laser excitable dyes and their method of use Life Technologies Corporation (US) 2012-04-17 US disclosed
US-20120004397-A1 VIOLET LASER EXCITABLE DYES AND THEIR METHOD OF USE Life Technologies Corporation (US) 2012-01-05 US disclosed
US-20070077549-A1 VIOLET LASER EXCITABLE DYES AND THEIR METHOD OF USE INVITROGEN CORPORATION (US) 2007-04-05 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-20130273569-A1 VIOLET LASER EXCITABLE DYES AND THEIR METHOD OF USE KLK3, ALDH1A2, SPR MAPT 378/4885L3MBTL1 1880/4885MMP1 2728/4885
US-20070077549-A1 VIOLET LASER EXCITABLE DYES AND THEIR METHOD OF USE KLK3, ALDH1A2, SPR MAPT 378/4885L3MBTL1 1880/4885MMP1 2728/4885
US-20120004397-A1 VIOLET LASER EXCITABLE DYES AND THEIR METHOD OF USE KLK3, ALDH1A2, SPR MAPT 378/4885L3MBTL1 1880/4885MMP1 2728/4885

“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.