SCHEMBL30336973

SCHEMBL30336973

O=C1NCC(=O)N2CCN(Cc3ccc4ccccc4c3)CC12

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.49
▸ ACHE P22303 2/20 0.45
▸ PKM P14618 1/20 0.45
▸ CHKA P35790 1/20 0.43
▸ OPRM1 P35372 2/20 0.43
▸ OPRL1 P41146 2/20 0.43
▸ MC4R P32245 1/20 0.43
▸ MC5R P33032 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ DRD4 P21917 1/20 0.42
▸ FAAH O00519 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ MEN1 O00255 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
SCHEMBL30337156 0.86 CHKA (0.50) CHKAFAAH
SCHEMBL24939957 0.86 F10 (0.41) KMT2APKM
SCHEMBL24152329 0.85 GSK3B (0.50) SIGMAR1
SCHEMBL28980917 0.84 FAAH (0.48) FAAH
SCHEMBL28980928 0.83 DRD2 (0.43) KMT2ACHKAOPRL1DRD4FAAH
SCHEMBL28980935 0.81 KDM4E (0.47) KMT2APOLBMEN1
SCHEMBL30337242 0.80 HTR1A (0.44) OPRM1OPRL1DRD4FAAH
SCHEMBL30337109 0.79 TSHR (0.47) KMT2AACHEOPRM1OPRL1DRD4
SCHEMBL30336993 0.78 TP53 (0.45) FAAH
SCHEMBL24145432 0.77 KMT2A (0.50) KMT2AACHEPKMOPRM1OPRL1

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
EP-4174068-A1 NOVEL COMPOUND, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING RESISTANT CANCER, COMPRISING SAME Holosmedic (KR) 2023-05-03 — — EP 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

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 KMT2A 3627/4885ACHE 4678/4885PKM 2397/4885

“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.

Send feedback