SCHEMBL3624915

SCHEMBL3624915

Cc1ccc2c(c1)NC(=O)c1cc(Cl)ccc1N2

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1G1 Q9HCP0 1/20 0.67
LRRK2 Q5S007 6/20 0.66
ROS1 P08922 1/20 0.66
CDK5 Q00535 1/20 0.66
ACVR1 Q04771 1/20 0.66
CHEK1 O14757 1/20 0.62
TGM2 P21980 2/20 0.62
CES1 P23141 2/20 0.62
NPC1 O15118 1/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP1A2 P05177 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
RAB9A P51151 1/20 0.51
MCL1 Q07820 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
IDO1 P14902 2/20 0.49
TDO2 P48775 2/20 0.49

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
SCHEMBL14985676 0.88 ACVR1 (0.83) CSNK1G1LRRK2ROS1CDK5ACVR1
SCHEMBL18462586 0.88 ACVR1 (0.83) CSNK1G1LRRK2ROS1CDK5ACVR1
SCHEMBL31139641 0.84 CES1 (0.77) LRRK2CHEK1TGM2CES1IDO1
SCHEMBL8506968 0.83 CHEK1 (0.65) LRRK2ROS1CDK5ACVR1CHEK1
SCHEMBL3614440 0.83 CHEK1 (0.81) CSNK1G1LRRK2ROS1CDK5ACVR1
SCHEMBL14985677 0.81 CSNK1G1 (0.77) CSNK1G1LRRK2ROS1CDK5ACVR1
SCHEMBL25666640 0.81 CSNK1G1 (0.67) CSNK1G1LRRK2ROS1CDK5ACVR1
SCHEMBL9185276 0.80 CSNK1G1 (1.00) CSNK1G1LRRK2ROS1CDK5ACVR1
SCHEMBL2756784 0.78 CSNK1G1 (0.63) CSNK1G1LRRK2ROS1CDK5ACVR1
SCHEMBL3411665 0.77 CHEK1 (0.67) CSNK1G1LRRK2ROS1CDK5ACVR1

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-8202989-B2 One step process for the preparation of substituted 5, 10-dihydrodibenzo [b,e][1, 4]diazepine-11-ones COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2012-06-19 US claimed
US-20100228023-A1 ONE STEP PROCESS FOR THE PREPARATION OF SUBSTITUTED 5, 10-DIHYDRODIBENZO [b,e][1, 4]DIAZEPINE-11-ONES COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2010-09-09 US claimed
US-8202989-B2 One step process for the preparation of substituted 5, 10-dihydrodibenzo [b,e][1, 4]diazepine-11-ones COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2012-06-19 US disclosed
US-20100228023-A1 ONE STEP PROCESS FOR THE PREPARATION OF SUBSTITUTED 5, 10-DIHYDRODIBENZO [b,e][1, 4]DIAZEPINE-11-ONES COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2010-09-09 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 (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-20100228023-A1 ONE STEP PROCESS FOR THE PREPARATION OF SUBSTITUTED 5, 10-DIHYDRODIBENZO [b,e][1, 4]DIAZEPINE-11-ONES BBOX1, CYP1B1, CYP4B1 CSNK1G1 2234/4885LRRK2 4616/4885ROS1 2526/4885

“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.