SCHEMBL25789591

SCHEMBL25789591

CCCCCCC(CCC)c1ccc2c(c1)oc1ccccc12

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ NQO1 P15559 1/20 0.44
▸ AHR P35869 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CYP2D6 P10635 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ PTPN1 P18031 1/20 0.37

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
SCHEMBL25800977 0.79 SRC (0.36) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL10579923 0.75 CYP2D6 (0.43) NPC1RAB9ASMN1; SMN2CYP2D6
SCHEMBL10583661 0.75 CYP2D6 (0.43) NPC1RAB9ASMN1; SMN2CYP2D6
SCHEMBL10583568 0.75 CYP2D6 (0.43) NPC1RAB9ASMN1; SMN2CYP2D6
SCHEMBL10583789 0.75 CYP2D6 (0.43) NPC1RAB9ASMN1; SMN2CYP2D6
SCHEMBL10580403 0.75 CYP2D6 (0.43) NPC1RAB9ASMN1; SMN2CYP2D6
SCHEMBL4873076 0.73 NR1I2 (0.46) —
SCHEMBL1331317 0.73 NR1I2 (0.46) —
SCHEMBL21633720 0.73 NR1I2 (0.46) —
SCHEMBL31175819 0.73 NR1I2 (0.46) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212135-A1 LIGHT EMITTING ELEMENT, AMINE COMPOUND FOR THE SAME, AND DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-06 — — 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-20230212135-A1 LIGHT EMITTING ELEMENT, AMINE COMPOUND FOR THE SAME, AND DISPLAY DEVICE INCLUDING THE SAME SLC1A2, SLC18A2, SLC18A1 NPC1 1479/4885RAB9A 2457/4885SMN1; SMN2 3099/4885

“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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