SCHEMBL24364211

SCHEMBL24364211

C[C@H]1CCC(c2cccc(OCCN(C)C)c2)NC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.47
CHRNA4 P43681 3/20 0.47
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 1/20 0.41
LTA4H P09960 1/20 0.40
BTK Q06187 1/20 0.40
ESR1 P03372 2/20 0.39
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
NOS1 P29475 1/20 0.36
NOS2 P35228 1/20 0.36
ESR2 Q92731 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL30551216 1.00 CHRNB2 (0.47) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL29346681 1.00 CHRNB2 (0.47) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL30551424 1.00 CHRNB2 (0.47) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL29980988 0.94 KDM4E (0.43) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL30471028 0.94 KDM4E (0.43) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL24364321 0.94 KDM4E (0.43) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL25321680 0.86 BTK (0.36) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL24365996 0.85 ESR1 (0.44) KDM4EALDH1A1LTA4HESR1KEAP1
SCHEMBL24366402 0.82 MAPT (0.54) CHRNB2CHRNA4KDM4EALDH1A1ESR1
SCHEMBL30470383 0.82 MAPT (0.54) CHRNB2CHRNA4KDM4EALDH1A1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 US disclosed
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 US disclosed
CN-116568677-A piperidin-1-yl-N-pyridin-3-yl-2-oxoacetamide derivatives useful for the treatment of MTAP deficiency and/or MTA accumulating cancers 探戈医药股份有限公司 2023-08-08 CN disclosed
WO-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
US-20220127256-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2022-04-28 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 (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-20220127256-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CHRNB2 3217/4885CHRNA4 2950/4885KDM4E 3895/4885
US-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CHRNB2 3217/4885CHRNA4 2950/4885KDM4E 3895/4885

“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.