SCHEMBL808524

SCHEMBL808524

COc1[c]c2ccccc2c(OC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.42
TUBB4A P04350 4/20 0.42
TUBB P07437 4/20 0.42
TUBA3C P0DPH7 4/20 0.42
TUBA1B P68363 4/20 0.42
TUBA4A P68366 4/20 0.42
TUBB4B P68371 4/20 0.42
TUBB3 Q13509 4/20 0.42
TUBB2A Q13885 4/20 0.42
TUBB8 Q3ZCM7 4/20 0.42
TUBA3E Q6PEY2 4/20 0.42
TUBA1A Q71U36 4/20 0.42
TUBA1C Q9BQE3 4/20 0.42
TUBB6 Q9BUF5 4/20 0.42
TUBB2B Q9BVA1 4/20 0.42
TUBB1 Q9H4B7 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
MAPK1 P28482 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL19732669 0.79 EP300 (0.43) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5143271 0.79 ALDH1A1 (0.40) SYKTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL19732775 0.79 EP300 (0.43) SYKSMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL20563021 0.77 CYP2A6 (0.40) SYKTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4306596 0.76 NQO2 (0.39) SYKSMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL5963191 0.75 MCL1 (0.37) SMN1; SMN2KDM4EALDH1A1NQO1LMNA
SCHEMBL2259297 0.73 ALDH1A1 (0.64) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8193889 0.72 SMN1; SMN2 (0.41) SMN1; SMN2KDM4EALDH1A1NQO1LMNA
SCHEMBL30503944 0.71 SMN1; SMN2 (0.61) SYKTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3670609 0.71 SMN1; SMN2 (0.61) SYKTUBB4ATUBBTUBA3CTUBA1B

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020071470-A1 PHTHALOCYANINE COMPOUND AND USE THEREOF 山本化成株式会社 2020-04-09 WO disclosed
US-20190292194-A1 INHIBITORS OF ERK AND METHODS OF USE KURA ONCOLOGY, INC. 2019-09-26 US disclosed
US-10301317-B2 Inhibitors of ERK and methods of use KURA ONCOLOGY, INC. (US) 2019-05-28 US disclosed
US-10227370-B2 Heparan sulfate/heparin mimetics with anti-chemokine and anti-inflammatory activity CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2019-03-12 US disclosed
US-20180237444-A1 INHIBITORS OF ERK AND METHODS OF USE KURA ONCOLOGY, INC. 2018-08-23 US disclosed
EP-3363800-A1 HETEROCYCLIC INHIBITORS OF ERK AND METHODS OF USE Kura Oncology, Inc. (US) 2018-08-22 EP disclosed
US-9951078-B2 Inhibitors of ERK and methods of use KURA ONCOLOGY, INC. (US) 2018-04-24 US disclosed
EP-3052096-B1 INHIBITORS OF ERK AND METHODS OF USE KURA ONCOLOGY INC (US) 2018-01-17 EP disclosed
US-9770461-B2 Tailored glycopolymers as anticoagulant heparin mimetics CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2017-09-26 US disclosed
US-20170226110-A1 INHIBITORS OF ERK AND METHODS OF USE KURA ONCOLOGY, INC. 2017-08-10 US disclosed
CN-101125833-A Optically active bisoxazoline compounds, process for production of the same and use thereof SUMITOMO CHEMICAL CO (JP) 2008-02-20 CN disclosed
US-7288674-B2 Optically active bisoxazoline compounds, process for production of the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-30 US disclosed
CN-1325446-C Method and device for producing cyclopropenyl compound ROHM & HAAS (US) 2007-07-11 CN disclosed
US-20060149077-A1 Optically active bisoxazoline compounds, process for production of the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-07-06 US disclosed
CN-1771236-A Optically active bisoxazoline compound, process for producing the same, and use thereof SUMITOMO CHEMICAL CO (JP) 2006-05-10 CN disclosed
EP-1593674-A1 OPTICALLY ACTIVE BISOXAZOLINE COMPOUNDS, PROCESS FOR PRODUCTION OF THE SAME AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2005-11-09 EP disclosed
CN-1457636-A Method and device for producing cyclopropenyl compound ROHM & HAAS (US) 2003-11-26 CN disclosed
EP-0283310-B1 N-BENZHYDRYL-SUBSTITUTED HETEROCYCLIC DERIVATIVES, THEIR PREPARATION AND THEIR USE Sankyo Company Limited (JP) 1993-05-26 EP disclosed
US-5028610-A Calcium Channel Blockers SANKYO COMPANY LIMITED (JP) 1991-07-02 US disclosed
EP-0283310-A1 N-Benzhydryl-substituted heterocyclic derivatives, their preparation and their use Sankyo Company Limited (JP) 1988-09-21 EP 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 (6 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-20060149077-A1 Optically active bisoxazoline compounds, process for production of the same and use thereof ACSL3, ADSL, SQLE SYK 2758/4885TUBB4A 1046/4885TUBB 921/4885
US-10301317-B2 Inhibitors of ERK and methods of use MAP3K1, MAP3K2, MAP3K6 SYK 964/4885TUBB4A 2445/4885TUBB 1661/4885
US-20170226110-A1 INHIBITORS OF ERK AND METHODS OF USE MAP3K1, MAP3K2, MAP3K6 SYK 964/4885TUBB4A 2445/4885TUBB 1661/4885
US-20180237444-A1 INHIBITORS OF ERK AND METHODS OF USE MAP3K1, MAP3K2, MAP3K6 SYK 964/4885TUBB4A 2445/4885TUBB 1661/4885
US-20190292194-A1 INHIBITORS OF ERK AND METHODS OF USE MAP3K1, MAP3K2, MAP3K6 SYK 964/4885TUBB4A 2445/4885TUBB 1661/4885
US-10227370-B2 Heparan sulfate/heparin mimetics with anti-chemokine and anti-inflammatory activity CCL2, CCL5, ACKR3 SYK 950/4885TUBB4A 2668/4885TUBB 3064/4885

“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.