SCHEMBL6545595

SCHEMBL6545595

C=Cc1cn(C(C)=O)c2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.62
MEN1 O00255 6/20 0.62
SMN1; SMN2 Q16637 2/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 3/20 0.53
RAB9A P51151 2/20 0.52
POLB P06746 7/20 0.51
HTT P42858 2/20 0.49
ACHE P22303 1/20 0.47
CREBBP Q92793 3/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 1/20 0.47
BRPF1 P55201 1/20 0.47
BRD9 Q9H8M2 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 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
SCHEMBL870631 0.85 KMT2A (0.59) KMT2AMEN1SMN1; SMN2GAAMAPT
SCHEMBL28568208 0.81 ALDH1A1 (0.51) KMT2AMEN1SMN1; SMN2MAPTCREBBP
SCHEMBL2561496 0.80 KMT2A (0.54) KMT2AMEN1SMN1; SMN2GAAMAPT
SCHEMBL2561497 0.80 KMT2A (0.54) KMT2AMEN1SMN1; SMN2GAAMAPT
SCHEMBL9668352 0.80 SMN1; SMN2 (0.66) KMT2AMEN1SMN1; SMN2GAAMAPT
SCHEMBL19760135 0.79 MEN1 (0.55) KMT2AMEN1SMN1; SMN2GAAMAPT
SCHEMBL887129 0.79 HTT (0.54) KMT2AMEN1SMN1; SMN2GAAMAPT
SCHEMBL28910812 0.79 NOTUM (0.59) KMT2AMEN1SMN1; SMN2GAAMAPT
SCHEMBL3866851 0.78 ALDH1A1 (0.73) KMT2AMEN1SMN1; SMN2GAAMAPT
SCHEMBL14570850 0.77 KMT2A (0.52) KMT2AMEN1SMN1; SMN2GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1257265-B1 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS BIOAGENCY AG (DE) 2004-01-21 EP claimed
US-20030036532-A1 Use of 2-phenylene diamine derivatives for the treatment of infections JOMAA PHARMAKA GMBH (DE) 2003-02-20 US claimed
EP-1068176-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS Jomaa, Hassan (DE) 2001-01-17 EP claimed
WO-2000027803-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS JOMAA, HASSAN (DE) 2000-05-18 WO claimed
EP-2569434-B1 COMPOSITIONS AND METHODS FOR TREATING LEUKEMIA AND RELATED DISORDERS DANA FARBER CANCER INST INC (US) 2019-09-04 EP disclosed
US-9763956-B2 Diagnostic and treatment methods in subjects having or at risk of developing resistance to cancer therapy THE BROAD INSTITUTE, INC. (US) 2017-09-19 US disclosed
US-9763956-B2 Diagnostic and treatment methods in subjects having or at risk of developing resistance to cancer therapy THE BROAD INSTITUTE, INC. (US) 2017-09-19 US disclosed
US-7199145-B2 Derivatives of hydantoins, thiohydantoins, pyrimidinediones and thioxopyrimidinones, their preparation processes and their use as medicaments SOCIETE DE CONSEILS DE RECHERCHES ET D' 'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S) (FR) 2007-04-03 US disclosed
EP-1257265-B1 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS BIOAGENCY AG (DE) 2004-01-21 EP disclosed
US-20030036532-A1 Use of 2-phenylene diamine derivatives for the treatment of infections JOMAA PHARMAKA GMBH (DE) 2003-02-20 US disclosed
EP-1068176-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS Jomaa, Hassan (DE) 2001-01-17 EP disclosed
WO-2000027803-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS JOMAA, HASSAN (DE) 2000-05-18 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 (1 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-20030036532-A1 Use of 2-phenylene diamine derivatives for the treatment of infections HRH2, ASPH, NQO2 KMT2A 1743/4885MEN1 3863/4885SMN1; SMN2 4081/4885

“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.