SCHEMBL3619161

SCHEMBL3619161

Cc1c(-c2ccccc2C(=O)O)ccc(N)c1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 2/20 0.53
ALDH1A1 P00352 4/20 0.44
MAPK1 P28482 3/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
THRB P10828 2/20 0.44
KMT2A Q03164 2/20 0.44
FOLH1 Q04609 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
RECQL P46063 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX12 P18054 1/20 0.44
KDM4E B2RXH2 3/20 0.43
NPC1 O15118 1/20 0.43
CASP3 P42574 1/20 0.43
RAB9A P51151 1/20 0.43
SENP8 Q96LD8 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL4789889 0.87 MYC (0.57) MYCALDH1A1MAPK1MEN1MAPT
SCHEMBL1590359 0.84 MYC (0.60) MYCALDH1A1MAPK1KMT2AFOLH1
SCHEMBL27663826 0.83 MYC (0.61) MYCALDH1A1MAPTFOLH1LMNA
SCHEMBL9450908 0.83 FOLH1 (0.47) MYCALDH1A1MAPK1MEN1MAPT
SCHEMBL29823919 0.83 FOLH1 (0.47) MYCALDH1A1MAPK1MEN1MAPT
SCHEMBL22684102 0.80 MYC (0.45) MYCALDH1A1MAPK1MEN1MAPT
SCHEMBL6142488 0.80 MYC (0.57) MYCALDH1A1MAPK1MEN1MAPT
Phthalic Acid SCHEMBL9869587 0.79 ALDH1A1 (0.50) MYCALDH1A1MEN1KMT2ALMNA
SCHEMBL28830921 0.79 MYC (0.55) MYCALDH1A1MAPK1KMT2AFOLH1
SCHEMBL6316188 0.79 MMP2 (0.55) MYCALDH1A1MAPK1MEN1MAPT

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 MYC 3670/4885ALDH1A1 18/4885MAPK1 796/4885

“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.