SCHEMBL13330639

SCHEMBL13330639

CC1(c2ccccc2)C=Cc2cccnc21

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
POLB P06746 1/20 0.30
CCR1 P32246 1/20 0.30
CCR5 P51681 1/20 0.30
CCR8 P51685 1/20 0.30
METAP1 P53582 1/20 0.30
BLM P54132 1/20 0.30
HIF1A Q16665 1/20 0.30
DOHH Q9BU89 1/20 0.30
P4HTM Q9NXG6 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL30008586 0.76 L3MBTL1 (0.35) KDM4ELMNACYP1A2POLBCCR1
SCHEMBL11545311 0.74 LMNA (0.33) MMP2MMP9KDM4ELMNAALDH1A1
SCHEMBL1692391 0.66 CYP1A2 (0.31) CYP1A2
SCHEMBL13330642 0.66 SLC6A2 (0.33) KDM4ELMNACYP1A2POLBCCR1
SCHEMBL18572160 0.63 CA12 (0.38)
SCHEMBL13330631 0.62 OPRL1 (0.37) KDM4E
SCHEMBL10694098 0.62 FDPS (0.34)
SCHEMBL8237320 0.62 HTR2C (0.41) CYP1A2ALDH1A1
SCHEMBL2125224 0.61 GAA (0.43) MMP2MMP9KDM4ELMNAALDH1A1
SCHEMBL31425525 0.61 NOS3 (0.34)

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-20100121065-A1 Phosphors with High Luminous Efficiency and Display Device Containing Them GRACEL DISPLAY INC. (KR) 2010-05-13 US disclosed
US-20100121065-A1 Phosphors with High Luminous Efficiency and Display Device Containing Them GRACEL DISPLAY INC. (KR) 2010-05-13 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-20100121065-A1 Phosphors with High Luminous Efficiency and Display Device Containing Them PPIP5K2, ACP1, INPP5B MMP2 4701/4885MMP9 4750/4885KDM4E 3497/4885

“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.