SCHEMBL533775

SCHEMBL533775

CCCCCCCCCCCCCCCCCCOC1CC(COc2ccc(C(c3ccc(OC)cc3)N(CC)C(=O)O)cc2)CC(OCCCCCCCCCCCCCCCCCC)C1OCCCCCCCCCCCCCCCCCC

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.36
FAAH O00519 1/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
PLA2G4B P0C869 2/20 0.35
PTGER4 P35408 1/20 0.35
PTGER2 P43116 1/20 0.35
RARB P10826 3/20 0.34
S1PR1 P21453 4/20 0.34
S1PR3 Q99500 3/20 0.34
S1PR5 Q9H228 3/20 0.34

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
SCHEMBL533740 0.83 MMP9 (0.38) MMP9MMP8MMP13LMNAPOLB
SCHEMBL3504560 0.83 FAAH (0.41) MMP9MMP8MMP13LMNAPOLB
SCHEMBL534408 0.81 SLC2A1 (0.40) MMP9MMP8MMP13LMNAPOLB
SCHEMBL13164734 0.79 MAPK1 (0.47) MMP9MMP8MMP13LMNAPOLB
SCHEMBL533781 0.79 TP53 (0.56) MMP9MMP8MMP13LMNAPOLB
SCHEMBL15908216 0.76 MMP9 (0.38) MMP9MMP8MMP13LMNAPOLB
SCHEMBL533766 0.75 LMNA (0.43) LMNATP53TSHRPLA2G4BRARB
SCHEMBL2016511 0.74 NPC1 (0.42) LMNATP53S1PR1S1PR3S1PR5
SCHEMBL15908236 0.74 SLC2A1 (0.40) MMP9MMP8MMP13LMNAPOLB
SCHEMBL2019737 0.70 CNR1 (0.46) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9169187-B2 Method of making peptides using diphenylmethane compound AJINOMOTO CO., INC. (JP) 2015-10-27 US disclosed
US-20140213761-A1 DIPHENYLMETHANE COMPOUND AJINOMOTO CO., INC (JP) 2014-07-31 US disclosed
EP-2415745-A1 DIPHENYLMETHANE COMPOUND Ajinomoto Co., Inc. (JP) 2012-02-08 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-20140213761-A1 DIPHENYLMETHANE COMPOUND CCKAR, VIP, CCKBR MMP9 3657/4885MMP8 4073/4885MMP13 3898/4885

“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.