SCHEMBL17540324

SCHEMBL17540324

CC(C)C(=O)Nc1cccc(C(=O)OCOC(=O)c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
MAPK1 P28482 1/20 0.56
RAB9A P51151 5/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
MAPT P10636 3/20 0.56
HTT P42858 2/20 0.56
NPC1 O15118 1/20 0.56
HSD17B10 Q99714 2/20 0.55
USP2 O75604 1/20 0.55
ADRB2 P07550 1/20 0.52
ADRB1 P08588 1/20 0.52
ADRB3 P13945 1/20 0.52
NPSR1 Q6W5P4 2/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
POLB P06746 2/20 0.50
RXFP1 Q9HBX9 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PKM P14618 1/20 0.50

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
SCHEMBL17540320 0.91 ALDH1A1 (0.55) ALDH1A1MAPK1RAB9ASMN1; SMN2MAPT
SCHEMBL10137686 0.87 RAB9A (0.74) ALDH1A1MAPK1RAB9ASMN1; SMN2MAPT
SCHEMBL14254837 0.86 ALDH1A1 (0.67) ALDH1A1MAPK1RAB9ASMN1; SMN2MAPT
SCHEMBL16068453 0.85 RAB9A (0.75) ALDH1A1RAB9ASMN1; SMN2MAPTHTT
SCHEMBL18115572 0.83 RAB9A (0.65) ALDH1A1RAB9ASMN1; SMN2MAPTHTT
SCHEMBL13406087 0.79 ALDH1A1 (0.62) ALDH1A1RAB9ASMN1; SMN2MAPTHTT
SCHEMBL11313977 0.78 POLB (0.64) ALDH1A1RAB9ASMN1; SMN2HTTNPC1
SCHEMBL7434602 0.77 ALDH1A1 (0.45) ALDH1A1MAPK1RAB9ASMN1; SMN2MAPT
SCHEMBL17928312 0.76 LMNA (0.55) ALDH1A1MAPK1RAB9ASMN1; SMN2NPC1
SCHEMBL7152680 0.76 ALDH1A1 (0.64) ALDH1A1MAPK1RAB9ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210332048-A1 MEROPENEM DERIVATIVES AND USES THEREOF KALA PHARMACEUTICALS, INC. 2021-10-28 US disclosed
US-11091487-B2 Meropenem derivatives and uses thereof KALA PHARMACEUTICALS, INC. (US) 2021-08-17 US disclosed
US-10392388-B2 Meropenem derivatives and uses thereof KALA PHARMACEUTICALS, INC. (US) 2019-08-27 US disclosed
US-20170349590-A1 MEROPENEM DERIVATIVES AND USES THEREOF OXFORD FINANCE LLC 2017-12-07 US disclosed
US-20170349590-A1 MEROPENEM DERIVATIVES AND USES THEREOF OXFORD FINANCE LLC 2017-12-07 US disclosed
US-9725451-B2 Meropenem derivatives and uses thereof KALA PHARMACEUTICALS, INC. (US) 2017-08-08 US disclosed
US-9725451-B2 Meropenem derivatives and uses thereof KALA PHARMACEUTICALS, INC. (US) 2017-08-08 US disclosed
US-20160039823-A1 Meropenem Derivatives and Uses Thereof KALA PHARMACEUTICALS, INC. (US) 2016-02-11 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 (5 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-20160039823-A1 Meropenem Derivatives and Uses Thereof SLCO1B1, SLCO2B1, ABCB11 ALDH1A1 2014/4885MAPK1 3396/4885RAB9A 585/4885
US-10392388-B2 Meropenem derivatives and uses thereof SLCO1B1, SLCO2B1, ABCB11 ALDH1A1 2014/4885MAPK1 3396/4885RAB9A 585/4885
US-20170349590-A1 MEROPENEM DERIVATIVES AND USES THEREOF SLCO1B1, SLCO2B1, ABCB11 ALDH1A1 2014/4885MAPK1 3396/4885RAB9A 585/4885
US-20210332048-A1 MEROPENEM DERIVATIVES AND USES THEREOF SLCO1B1, SLCO2B1, ABCB11 ALDH1A1 2014/4885MAPK1 3396/4885RAB9A 585/4885
US-11091487-B2 Meropenem derivatives and uses thereof SLCO1B1, SLCO2B1, ABCB11 ALDH1A1 2014/4885MAPK1 3396/4885RAB9A 585/4885

“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.