SCHEMBL26530067

SCHEMBL26530067

Cc1cc(C(=O)N2CCC(Cn3cc(-c4ccccc4)nn3)CC2)nn1C

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ NR2E1 Q9Y466 1/20 0.48
▸ NAMPT P43490 2/20 0.44
▸ MGLL Q99685 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ KCNJ6 P48051 1/20 0.42
▸ KCNJ5 P48544 1/20 0.42
▸ KCNJ3 P48549 1/20 0.42
▸ HTR2A P28223 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ GBA1 P04062 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
SCHEMBL26530058 0.85 NR2E1 (0.44) RAB9ANPC1NR2E1NAMPTKDM4E
SCHEMBL23260733 0.84 NR2E1 (0.42) RAB9ANR2E1NAMPTKDM4EALDH1A1
SCHEMBL26530078 0.83 NR2E1 (0.43) RAB9ANR2E1MGLLKDM4EALDH1A1
SCHEMBL26530064 0.81 NR2E1 (0.43) RAB9ANR2E1NAMPTKDM4EALDH1A1
SCHEMBL26530072 0.81 SLC9A1 (0.40) RAB9ANR2E1KDM4EALDH1A1LMNA
SCHEMBL26535614 0.80 SLC9A1 (0.45) RAB9ANR2E1KDM4EALDH1A1LMNA
SCHEMBL26530068 0.79 NR2E1 (0.38) RAB9ANR2E1NAMPTKDM4EALDH1A1
SCHEMBL26529918 0.74 NR2E1 (0.53) RAB9ANR2E1NAMPTMGLLKDM4E
SCHEMBL26530033 0.74 NR2E1 (0.49) RAB9ANPC1NR2E1MGLLKDM4E
SCHEMBL23260468 0.70 NR2E1 (0.46) RAB9ANR2E1NAMPTMGLLKDM4E

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-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-10-12 — — US disclosed
US-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-10-12 — — 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 (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-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS YTHDF1, YTHDF3, YTHDF2 RAB9A 2759/4885NPC1 2308/4885NR2E1 2168/4885

“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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