SCHEMBL2199956

SCHEMBL2199956

O=C1OCc2c1cnc(Cl)c2Cl

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.34
MAOB P27338 4/20 0.34
KCNJ1 P48048 1/20 0.33
ALOX5 P09917 4/20 0.33
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TYMS P04818 1/20 0.30
CYP1A2 P05177 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL2201287 0.71 CHEK1 (0.36) MAOAMAOBGAAMAPTCYP1A2
SCHEMBL2200286 0.70 KCNJ1 (0.44) MAOAMAOBKCNJ1ALOX5LMNA
SCHEMBL855938 0.69 ALOX5 (0.39) MAOAMAOBKCNJ1ALOX5LMNA
SCHEMBL854575 0.69 KCNJ1 (0.46) MAOAMAOBKCNJ1ALOX5LMNA
SCHEMBL12444323 0.68 KDM4E (0.45) KCNJ1KDM4ECYP1A2CYP2C19
SCHEMBL7412699 0.68 ALOX5 (0.42) MAOAMAOBKCNJ1ALOX5MAPT
SCHEMBL31084562 0.67 MAPT (0.44) MAOAMAOBKCNJ1LMNAGAA
SCHEMBL903470 0.67 MAPT (0.44) MAOAMAOBKCNJ1LMNAGAA
SCHEMBL861759 0.67 MAOA (0.38) MAOAMAOBKCNJ1ALOX5LMNA
SCHEMBL855133 0.67 KCNJ1 (0.44) MAOAMAOBKCNJ1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455535-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2013-06-04 US disclosed
US-20110257238-A1 Heteroaryl Dihydroindolones as Kinase Inhibitors ALLERGAN, INC. (US) 2011-10-20 US disclosed
US-7977351-B2 Heteroaryl dihydroindolones as kinase inhibitors ALLERGAN, INC. (US) 2011-07-12 US disclosed
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. 2008-02-21 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 (2 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-20110257238-A1 Heteroaryl Dihydroindolones as Kinase Inhibitors REN, JAK2, ABL1 MAOA 1387/4885MAOB 958/4885KCNJ1 2909/4885
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS REN, JAK2, ABL1 MAOA 1387/4885MAOB 958/4885KCNJ1 2909/4885

“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.