SCHEMBL29454653

SCHEMBL29454653

COC(=O)C[C@H](c1cccc(C(=O)OCc2ccccc2)c1)C1CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.49
TDP1 Q9NUW8 3/20 0.47
KMT2A Q03164 2/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
NPC1 O15118 4/20 0.44
ALDH1A1 P00352 6/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
LMNA P02545 4/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.42
FFAR1 O14842 1/20 0.42
F2 P00734 1/20 0.41
F10 P00742 1/20 0.41
POLB P06746 2/20 0.40
ABCB1 P08183 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL22717401 0.84 FFAR1 (0.43) KMT2AALDH1A1KDM4EFFAR1F2
SCHEMBL22717404 0.84 FFAR1 (0.43) KMT2AALDH1A1KDM4EFFAR1F2
SCHEMBL29454586 0.84 FFAR1 (0.43) KMT2AALDH1A1KDM4EFFAR1F2
SCHEMBL29454565 0.82 FFAR1 (0.59) KMT2ASMN1; SMN2FFAR1
SCHEMBL21644935 0.82 FFAR1 (0.59) KMT2ASMN1; SMN2FFAR1
SCHEMBL20103667 0.82 FFAR1 (0.59) KMT2ASMN1; SMN2FFAR1
SCHEMBL29454654 0.81 MAPT (0.49) TDP1KMT2AALDH1A1LMNAMAPT
SCHEMBL21688300 0.79 FFAR1 (0.56) RAB9AKMT2AALDH1A1SMN1; SMN2FFAR1
SCHEMBL22717051 0.79 ALDH1A1 (0.43) RAB9AKMT2ANPC1ALDH1A1SMN1; SMN2
SCHEMBL29454590 0.79 ALDH1A1 (0.43) RAB9AKMT2ANPC1ALDH1A1SMN1; SMN2

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-20220226298-A1 GPR40 AGONISTS KALLYOPE, INC. 2022-07-21 US disclosed
EP-3976576-A1 GPR40 AGONISTS Kallyope, Inc. (US) 2022-04-06 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-20220226298-A1 GPR40 AGONISTS GPR119, GPR65, GLP1R RAB9A 2945/4885TDP1 4444/4885KMT2A 1750/4885

“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.