SCHEMBL985155

SCHEMBL985155

NC(=C(N)c1cccc(N)c1N)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
GAA P10253 1/20 0.52
MMP2 P08253 1/20 0.38
HSD17B10 Q99714 3/20 0.37
ALDH1A1 P00352 1/20 0.37
CFTR P13569 1/20 0.37
POLB P06746 2/20 0.37
BLM P54132 2/20 0.37
CYP3A4 P08684 2/20 0.37
RECQL P46063 2/20 0.37
F2 P00734 1/20 0.37
F10 P00742 1/20 0.37
F12 P00748 1/20 0.37
F7 P08709 1/20 0.37
F3 P13726 1/20 0.37
PKM P14618 1/20 0.37
PARP1 P09874 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
PMP22 Q01453 1/20 0.37

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
SCHEMBL5702495 0.87 MAPT (0.59) MAPTGAAMMP2HSD17B10ALDH1A1
SCHEMBL1286400 0.78 MAPT (0.48) MAPTGAAMMP2HSD17B10ALDH1A1
SCHEMBL7160188 0.76 MAPT (0.47) MAPTGAAMMP2HSD17B10ALDH1A1
Benzene SCHEMBL28303083 0.76 MAPT (0.74) MAPTGAAMMP2HSD17B10ALDH1A1
SCHEMBL636319 0.76 MAPT (0.47) MAPTGAAMMP2HSD17B10ALDH1A1
SCHEMBL112508 0.76 MAPT (0.74) MAPTGAAMMP2HSD17B10ALDH1A1
SCHEMBL29786713 0.76 MAPT (0.74) MAPTGAAMMP2HSD17B10ALDH1A1
SCHEMBL38341 0.75 BLM (0.58) MAPTGAAHSD17B10ALDH1A1POLB
SCHEMBL1766180 0.75 BLM (0.58) MAPTGAAHSD17B10ALDH1A1POLB
SCHEMBL1282296 0.75 BLM (0.58) MAPTGAAHSD17B10ALDH1A1POLB

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
JP-56139440-A None JP disclosed
US-20110269845-A1 INTERFERENCE PIGMENTS ON THE BASIS OF PERLITE FLAKES BASF SE (DE) 2011-11-03 US disclosed
US-20110008399-A1 USE OF ZERO-ORDER DIFFRACTIVE PIGMENTS BASF SE (DE) 2011-01-13 US disclosed
JP-S56139440-A N,N'-DISTUBSTITUTED DIAMINOSTILBENE AND ITS USE MITSUI PETROCHEM IND LTD 1981-10-30 JP 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-20110008399-A1 USE OF ZERO-ORDER DIFFRACTIVE PIGMENTS MITF, TYR, DCX MAPT 234/4885GAA 2655/4885MMP2 2595/4885

“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.