SCHEMBL5026091

SCHEMBL5026091

CCCCOc1c(OC)cc(C(=O)O)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 4/20 0.56
TPMT P51580 1/20 0.56
PLA2G4B P0C869 1/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA3 P07451 1/20 0.53
PKM P14618 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53
CA14 Q9ULX7 1/20 0.53
CA5B Q9Y2D0 1/20 0.53
PLA2G2A P14555 1/20 0.53
TSHR P16473 1/20 0.51

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
Hydrochloric Acid SCHEMBL16143391 0.98 SLC6A5 (0.55) SLC6A5TPMTPLA2G4BCA12CA1
SCHEMBL12431955 0.95 PLA2G2A (0.59) SLC6A5TPMTPLA2G4BCA12CA1
SCHEMBL12431968 0.94 PLA2G2A (0.62) PLA2G4BPLA2G2ATSHR
SCHEMBL11435088 0.94 PLA2G2A (0.62) PLA2G4BPLA2G2ATSHR
SCHEMBL38650624 0.94 PLA2G2A (0.62) PLA2G4BPLA2G2ATSHR
SCHEMBL8636608 0.92 SMN1; SMN2 (0.60) SLC6A5TPMTCA12CA1CA2
SCHEMBL17874346 0.91 TPMT (0.61) TPMTCA12CA1CA2CA3
SCHEMBL7995915 0.90 PLA2G2A (0.56) PLA2G4BPLA2G2ATSHR
SCHEMBL18033251 0.90 LMNA (0.49) SLC6A5TPMTPLA2G4BCA12CA1
SCHEMBL19970624 0.87 TPMT (0.56) TPMTCA12CA1CA2CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2786986-B1 NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF VIVOZON INC (KR) 2018-02-28 EP disclosed
EP-2786986-B1 NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF VIVOZON INC (KR) 2018-02-28 EP disclosed
CN-103958477-B Benzamide derivatives and uses thereof (株)威沃尊 2017-03-29 CN disclosed
US-9359346-B2 Benzamide derivative and use thereof VIVOZON, INC. (KR) 2016-06-07 US disclosed
US-9359346-B2 Benzamide derivative and use thereof VIVOZON, INC. (KR) 2016-06-07 US disclosed
US-9359346-B2 Benzamide derivative and use thereof VIVOZON, INC. (KR) 2016-06-07 US disclosed
US-20140336378-A1 NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF VIVOZON, INC. (KR) 2014-11-13 US disclosed
US-20140336378-A1 NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF VIVOZON, INC. (KR) 2014-11-13 US disclosed
US-20140336378-A1 NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF VIVOZON, INC. (KR) 2014-11-13 US disclosed
EP-2786986-A2 NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF Vivozon Inc. (KR) 2014-10-08 EP disclosed
WO-2013081400-A2 NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF 주식회사 비보존 (KR) 2013-06-06 WO disclosed
EP-1419138-B1 N- (1-DIMETHYLAMINOCYCLOALKYL)METHYL BENZAMIDE DERIVATIVES ORGANON NV (NL) 2008-10-29 EP disclosed
US-7126027-B2 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives AKZO NOBEL N.V. (NL) 2006-10-24 US disclosed
US-20040242685-A1 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives N.V. ORGANON (NL) 2004-12-02 US disclosed
EP-1419138-A1 N- (1-DIMETHYLAMINOCYCLOALKYL)METHYL]BENZAMIDE DERIVATIVES Akzo Nobel (NL) 2004-05-19 EP disclosed
WO-2003010132-A1 N-[(1-DIMETHYLAMINOCYCLOALKYL)METHYL]BENZAMIDE DERIVATIVES AKZO NOBEL N.V. (NL) 2003-02-06 WO 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 (2 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-20140336378-A1 NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF TRPV1, TRPA1, TRPV5 SLC6A5 1714/4885TPMT 2755/4885PLA2G4B 1307/4885
US-20040242685-A1 N-[(1-dimethylaminocycloalkyl)methyl]benzamide derivatives SLC1A2, SLC6A1, KCNT2 SLC6A5 26/4885TPMT 282/4885PLA2G4B 2128/4885

“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.