SCHEMBL3868210

SCHEMBL3868210

CC(=O)c1ccc(CCNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.54
CA1 P00915 2/20 0.54
NAMPT P43490 1/20 0.53
MAPT P10636 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 1/20 0.47
ESRRG P62508 3/20 0.47
ESRRB O95718 1/20 0.47
EPHX2 P34913 1/20 0.46
NR1H4 Q96RI1 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NQO2 P16083 1/20 0.45
KDM4E B2RXH2 1/20 0.45
F13A1 P00488 1/20 0.45
LMNA P02545 1/20 0.45
GLA P06280 1/20 0.44

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
SCHEMBL379892 0.88 CA2 (0.54) CA2CA1NAMPTMAPTSMN1; SMN2
SCHEMBL7808431 0.87 CA2 (0.56) CA2CA1NAMPTMAPTALDH1A1
SCHEMBL1936202 0.87 MGLL (0.55) CA2CA1NAMPTMAPTALDH1A1
SCHEMBL2511243 0.85 CA2 (0.55) CA2CA1NAMPTMAPTSMN1; SMN2
SCHEMBL12511497 0.85 CA2 (0.52) CA2CA1NAMPTMAPTSMN1; SMN2
SCHEMBL27741035 0.84 CA2 (0.56) CA2CA1NAMPTMAPTSMN1; SMN2
SCHEMBL12283041 0.84 NPC1 (0.60) CA2CA1NAMPTMAPTSMN1; SMN2
SCHEMBL100146 0.84 KDM4E (0.60) CA2CA1NAMPTMAPTSMN1; SMN2
SCHEMBL1569661 0.84 CA2 (0.56) CA2CA1NAMPTMAPTSMN1; SMN2
SCHEMBL8127981 0.84 EPHX2 (0.59) CA2CA1NAMPTMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4368184-A2 NOVEL COMPOUNDS FOR THE DIAGNOSIS, TREATMENT AND PREVENTION OF DISEASES ASSOCIATED WITH THE AGGREGATION OF ALPHA-SYNUCLEIN Modag GmbH (DE) 2024-05-15 EP disclosed
US-20230067910-A1 NOVEL COMPOUNDS FOR THE DIAGNOSIS, TREATMENT AND PREVENTION OF DISEASES ASSOCIATED WITH THE AGGREGATION OF ALPHA-SYNUCLEIN MODAG GMBH (DE) 2023-03-02 US disclosed
EP-4061807-A1 NOVEL COMPOUNDS FOR THE DIAGNOSIS, TREATMENT AND PREVENTION OF DISEASES ASSOCIATED WITH THE AGGREGATION OF ALPHA-SYNUCLEIN Modag GmbH (DE) 2022-09-28 EP disclosed
US-7601868-B2 Such as 4-(cyclopropylmethoxy)-N-(2-{4-[1-(1-pyrrolidinyl)ethyl]phenyl}ethyl)benzamide having melanin-concentrating hormone antagonistic action, for prophylaxis and/or treatment of obesity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-13 US disclosed
US-20060128690-A1 Amine derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-15 US disclosed
EP-1593667-A1 AMINE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2005-11-09 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 (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-20230067910-A1 NOVEL COMPOUNDS FOR THE DIAGNOSIS, TREATMENT AND PREVENTION OF DISEASES ASSOCIATED WITH THE AGGREGATION OF ALPHA-SYNUCLEIN SNCA, PARK7, SYNCRIP CA2 3599/4885CA1 3948/4885NAMPT 3741/4885
US-20060128690-A1 Amine derivative MC1R, MC2R, MC4R CA2 3719/4885CA1 4236/4885NAMPT 3153/4885

“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.