SCHEMBL2975818

SCHEMBL2975818

CCCC1(c2ccccc2)N=C(C)NC1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.41
MMP9 P14780 2/20 0.41
MMP3 P08254 1/20 0.41
KMT2A Q03164 3/20 0.38
TSHR P16473 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 3/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
BACE1 P56817 2/20 0.37
BACE2 Q9Y5Z0 2/20 0.37
GLA P06280 1/20 0.37
THRB P10828 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
SCHEMBL2980975 0.72 BACE1 (0.61) MMP2MMP9KMT2ATSHRMEN1
SCHEMBL16284717 0.69 MAPT (0.40) MMP2MMP9MMP3KMT2AMEN1
SCHEMBL543080 0.68 MMP9 (0.40) MMP2MMP9TSHRCYP1A2POLB
SCHEMBL3655113 0.67 ADAM17 (0.59) MMP2MMP9MMP3ALDH1A1CYP2C9
SCHEMBL11262329 0.62 MMP2 (0.42) MMP2MMP9MMP3KMT2ATSHR
SCHEMBL4229144 0.61 BACE1 (0.56) MMP2MMP9KMT2ACYP1A2LMNA
SCHEMBL28873103 0.61 CYP2C19 (0.39) MMP2MMP9MMP3KMT2ATSHR
SCHEMBL7243685 0.60 MMP2 (0.61) MMP2MMP9MMP3ALDH1A1CYP2C9
SCHEMBL8958172 0.60 BACE1 (0.50) MMP2MMP9MMP3KMT2ATSHR
SCHEMBL5275530 0.60 KDM4E (0.35) MMP2MMP9MMP3KMT2ATSHR

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-7786155-B2 Organic compounds NOVARTIS AG (CH) 2010-08-31 US disclosed
US-20090099244-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-04-16 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-20090099244-A1 ORGANIC COMPOUNDS SLCO4C1, SLC10A6, SLCO1B1 MMP2 4364/4885MMP9 3870/4885MMP3 3508/4885

“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.