SCHEMBL24364321

SCHEMBL24364321

C[C@H]1CC[C@H](c2cccc(OCCCN(C)C)c2)NC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HRH3 Q9Y5N1 4/20 0.41
CHRNB2 P17787 2/20 0.40
CHRNA4 P43681 2/20 0.40
ESR1 P03372 2/20 0.40
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
LSS P48449 1/20 0.38
LMNA P02545 2/20 0.38
BCHE P06276 1/20 0.36
MAOA P21397 1/20 0.36
ACHE P22303 1/20 0.36
MAOB P27338 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
SCHEMBL29980988 1.00 KDM4E (0.43) KDM4EALDH1A1SMN1; SMN2HRH3CHRNB2
SCHEMBL30471028 1.00 KDM4E (0.43) KDM4EALDH1A1SMN1; SMN2HRH3CHRNB2
SCHEMBL30551216 0.94 CHRNB2 (0.47) KDM4EALDH1A1SMN1; SMN2CHRNB2CHRNA4
SCHEMBL24364211 0.94 CHRNB2 (0.47) KDM4EALDH1A1SMN1; SMN2CHRNB2CHRNA4
SCHEMBL30551424 0.94 CHRNB2 (0.47) KDM4EALDH1A1SMN1; SMN2CHRNB2CHRNA4
SCHEMBL29346681 0.94 CHRNB2 (0.47) KDM4EALDH1A1SMN1; SMN2CHRNB2CHRNA4
SCHEMBL24233755 0.81 SIGMAR1 (0.37)
SCHEMBL24364939 0.81 SIGMAR1 (0.37)
SCHEMBL30469656 0.81 SIGMAR1 (0.37)
SCHEMBL25320597 0.80 USP2 (0.35)

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 3 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
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 KDM4E 3895/4885ALDH1A1 128/4885SMN1; SMN2 1943/4885
US-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 KDM4E 3895/4885ALDH1A1 128/4885SMN1; SMN2 1943/4885

“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.