SCHEMBL24320321

SCHEMBL24320321

CC(=O)Nc1ccc(NC[C@@H]2CCO2)c(N)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
MEN1 O00255 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
POLB P06746 1/20 0.43
HDAC1 Q13547 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GAA P10253 1/20 0.41
PTGER4 P35408 1/20 0.41
HDAC3 O15379 1/20 0.41

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
SCHEMBL26914476 1.00 TDP1 (0.44) TDP1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL25367422 0.89 RAB9A (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL25367416 0.89 RAB9A (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL5881733 0.84 PTGER4 (0.56) TDP1ALDH1A1CYP1A2CYP2C19KDM4E
SCHEMBL1609124 0.84 PTGER4 (0.48) TDP1ALDH1A1MAPTCYP1A2CYP2C19
SCHEMBL24306987 0.84 CA12 (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL30537065 0.84 CA12 (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL29052863 0.84 CA12 (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL26914012 0.81 MAPT (0.60) TDP1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL26914018 0.81 MAPT (0.60) TDP1RAB9ANPC1SMN1; SMN2ALDH1A1

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-20230391760-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2023-12-07 US disclosed
WO-2022078407-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2022-04-21 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 (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-20230391760-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, GCGR TDP1 2792/4885RAB9A 788/4885NPC1 1207/4885

“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.