SCHEMBL356336

SCHEMBL356336

CCCNc1ccc(C(F)(F)F)cc1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 3/20 0.51
KDM4E B2RXH2 2/20 0.51
GAA P10253 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
GFER P55789 1/20 0.51
CFTR P13569 1/20 0.43
LMNA P02545 2/20 0.42
ATM Q13315 1/20 0.42
TRPA1 O75762 3/20 0.42
CYP1A2 P05177 1/20 0.42
EGFR P00533 1/20 0.41
POLB P06746 2/20 0.40
KIF11 P52732 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PRSS1 P07477 1/20 0.39

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
SCHEMBL7191685 0.90 L3MBTL1 (0.49) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL20198518 0.88 MAPT (0.47) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL29699082 0.87 KDM4E (0.39) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL376223 0.87 KDM4E (0.39) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL356817 0.87 LMNA (0.43) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL356011 0.86 ALDH1A1 (0.54) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL28367018 0.84 KDM4E (0.37) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL5023620 0.83 ALDH1A1 (0.51) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL28991315 0.83 KDM4E (0.36) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL3469834 0.83 KDM4E (0.42) L3MBTL1ALDH1A1MAPTKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9895376-B2 Fused tricyclic compounds as Raf kinase inhibitors BEIGENE, LTD. (KY) 2018-02-20 US disclosed
US-20160206621-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEONE MEDICINES I GMBH (CH) 2016-07-21 US disclosed
US-9273046-B2 Fused tricyclic compounds as Raf kinase inhibitors BEIGENE, LTD. (KY) 2016-03-01 US disclosed
US-20150045355-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BEONE MEDICINES I GMBH (CH) 2015-02-12 US disclosed
EP-2424856-B1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2014-12-31 EP disclosed
EP-2424856-B1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2014-12-31 EP disclosed
US-8461181-B2 Fused heterocyclic compound and use thereof SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2013-06-11 US disclosed
US-8461181-B2 Fused heterocyclic compound and use thereof SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2013-06-11 US disclosed
US-8273764-B2 Fused heterocyclic compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-25 US disclosed
US-8273764-B2 Fused heterocyclic compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-25 US disclosed
US-20070099899-A1 Heterocyclic dihydropyrimidine compounds ATWAL KARNAIL S 2007-05-03 US disclosed
US-7157451-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-02 US disclosed
US-7157451-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-02 US disclosed
US-7157451-B2 Heterocyclic dihydropyrimidine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-02 US disclosed
US-20040063687-A1 Heterocyclic dihydropyrimidine compounds ATWAL KARNAIL S (US) 2004-04-01 US disclosed
US-6706720-B2 TREATMENT OF ARRHYTHMIA; INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2004-03-16 US disclosed
CN-1407985-A Heterocyclic dihydropyrimidines as potassium channel inhibitors BRISTOL MYERS SQUIBB CO (US) 2003-04-02 CN disclosed
US-20030022890-A1 Heterocyclic dihydropyrimidine compounds PEDESTRIAN CONCEPTS LLC 2003-01-30 US disclosed
EP-1237891-A1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-09-11 EP disclosed
WO-2001040231-A1 HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-06-07 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 (5 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-20160206621-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF L3MBTL1 1159/4885ALDH1A1 2551/4885MAPT 3008/4885
US-20040063687-A1 Heterocyclic dihydropyrimidine compounds KCNJ2, KCNH2, KCNH1 L3MBTL1 1779/4885ALDH1A1 2042/4885MAPT 3600/4885
US-20030022890-A1 Heterocyclic dihydropyrimidine compounds KCNJ2, KCNH2, KCNH1 L3MBTL1 1779/4885ALDH1A1 2042/4885MAPT 3600/4885
US-20070099899-A1 Heterocyclic dihydropyrimidine compounds KCNJ2, KCNQ5, KCNQ2 L3MBTL1 1280/4885ALDH1A1 2928/4885MAPT 3321/4885
US-20150045355-A1 FUSED TRICYCLIC COMPOUNDS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF L3MBTL1 1159/4885ALDH1A1 2551/4885MAPT 3008/4885

“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.