SCHEMBL3784883

SCHEMBL3784883

Cc1ccc(-c2cccc(N)c2)c(C)c1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
MAOA P21397 1/20 0.45
MAP4K4 O95819 4/20 0.45
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 3/20 0.41
NPC1 O15118 3/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
GFER P55789 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
BRD4 O60885 1/20 0.41
RECQL P46063 2/20 0.40
TSHR P16473 1/20 0.40
MAOB P27338 1/20 0.40
PLA2G7 Q13093 1/20 0.40
CYP3A4 P08684 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
SCHEMBL31174707 1.00 POLB (0.57) POLBMAOAMAP4K4ALDH1A1KDM4E
SCHEMBL31607643 1.00 POLB (0.57) POLBMAOAMAP4K4ALDH1A1KDM4E
SCHEMBL31607626 0.85 MAOA (0.45) POLBMAOAMAP4K4ALDH1A1NPC1
SCHEMBL31607612 0.85 MAOA (0.45) POLBMAOAMAP4K4ALDH1A1NPC1
SCHEMBL3784859 0.85 MAOA (0.45) POLBMAOAMAP4K4ALDH1A1NPC1
SCHEMBL9677424 0.82 PLA2G7 (0.52) MAOAMAP4K4ALDH1A1BRD4RECQL
SCHEMBL28327124 0.82 MAOA (0.42) MAOAMAP4K4ALDH1A1KDM4EMAPT
SCHEMBL3781453 0.81 MAP4K4 (0.50) MAOAMAP4K4ALDH1A1KDM4ENPC1
SCHEMBL10935618 0.80 POLB (0.67) POLBALDH1A1KDM4ENPC1MAPT
SCHEMBL3789628 0.79 MAOA (0.47) MAOAMAP4K4ALDH1A1KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 POLB 2303/4885MAOA 348/4885MAP4K4 3704/4885

“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.