SCHEMBL1270426

SCHEMBL1270426

NC(=O)CCC(N)C(=O)NC(=O)CNC(=O)[C@@H](N)Cc1c[nH]c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
LMNA P02545 1/20 0.53
MPO P05164 1/20 0.53
MAPT P10636 1/20 0.53
TSHR P16473 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
KMT2A Q03164 1/20 0.53
HIF1A Q16665 1/20 0.53
CTSC P53634 4/20 0.49
OPRM1 P35372 2/20 0.48
OPRD1 P41143 2/20 0.48
HDAC8 Q9BY41 2/20 0.48
SOS1 Q07889 2/20 0.47
NLN Q9BYT8 1/20 0.47
KRAS P01116 1/20 0.47
CTSL P07711 2/20 0.45
RUVBL1 Q9Y265 1/20 0.45
HDAC3 O15379 1/20 0.45

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
SCHEMBL1272199 0.91 CTSC (0.53) KDM4EMEN1LMNAMPOMAPT
SCHEMBL30834724 0.85 OPRM1 (0.56) KDM4EMEN1LMNAMPOMAPT
SCHEMBL26605070 0.85 KDM4E (0.60) KDM4EMEN1LMNAMPOMAPT
SCHEMBL26605065 0.85 KDM4E (0.60) KDM4EMEN1LMNAMPOMAPT
SCHEMBL16317501 0.85 KDM4E (0.65) KDM4EMEN1LMNAMPOMAPT
SCHEMBL29378473 0.85 KDM4E (0.65) KDM4EMEN1LMNAMPOMAPT
SCHEMBL18541537 0.85 KDM4E (0.65) KDM4EMEN1LMNAMPOMAPT
SCHEMBL1271007 0.83 CTSL (0.62) MAPTCTSLBCHEACHE
SCHEMBL1270414 0.81 CTSC (0.51) KDM4EMEN1LMNAMPOMAPT
SCHEMBL7593998 0.81 KDM4E (0.63) KDM4EMEN1LMNAMPOMAPT

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-20110038885-A1 CHEMOKINE ANALOGS IPSEN PHARMA S.A.S. (FR) 2011-02-17 US claimed
US-20110038885-A1 CHEMOKINE ANALOGS IPSEN PHARMA S.A.S. (FR) 2011-02-17 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-20110038885-A1 CHEMOKINE ANALOGS CCL11, CCL5, CCL2 KDM4E 4825/4885MEN1 2251/4885LMNA 4604/4885

“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.