SCHEMBL24152329

SCHEMBL24152329

O=C1NCC(=O)N2CCN(Cc3ccccc3)CC12

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.50
▸ GSK3A P49840 1/20 0.50
▸ TACR1 P25103 6/20 0.45
▸ SIGMAR1 Q99720 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CHRM3 P20309 4/20 0.42
▸ CHRM2 P08172 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ DRD2 P14416 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
SCHEMBL28980928 0.92 DRD2 (0.43) GSK3BGSK3ATACR1ALDH1A1CYP2D6
SCHEMBL30336973 0.85 KMT2A (0.49) SIGMAR1
SCHEMBL1351210 0.85 DRD2 (0.44) GSK3BGSK3ATACR1SIGMAR1CHRM3
SCHEMBL30336993 0.84 TP53 (0.45) SMN1; SMN2ALDH1A1CYP1A2CYP2C19
SCHEMBL24939886 0.84 HTR6 (0.45) —
SCHEMBL30336981 0.82 LMNA (0.41) SIGMAR1ALDH1A1
SCHEMBL24938858 0.82 ALDH1A1 (0.45) GSK3BGSK3ASMN1; SMN2ALDH1A1CYP1A2
SCHEMBL24939938 0.82 P2RX4 (0.38) GSK3BGSK3ACYP1A2CYP2C19DRD2
SCHEMBL28980918 0.82 ALDH1A1 (0.39) GSK3BGSK3ATACR1SIGMAR1SMN1; SMN2
SCHEMBL28980917 0.81 FAAH (0.48) —

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-20240101562-A1 NOVEL COMPOUND, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING RESISTANT CANCER, COMPRISING SAME HOLOSMEDIC (KR) 2024-03-28 — — US disclosed
CN-115916206-A Novel compound and pharmaceutical composition for preventing or treating resistant cancer comprising same 治愈医药社株式会社 2023-04-04 — — CN disclosed
WO-2021261969-A1 PREPARATION METHOD FOR NOVEL COMPOUND 홀로스메딕 주식회사 2021-12-30 — — 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-20240101562-A1 NOVEL COMPOUND, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING RESISTANT CANCER, COMPRISING SAME SLC11A2, ABCC1, TSG101 GSK3B 2604/4885GSK3A 2645/4885TACR1 2264/4885

“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.

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