SCHEMBL24237482

SCHEMBL24237482

CNn1c2c(C)cccc2c2ccc(C)c(C)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALKBH5 Q6P6C2 1/20 0.41
▸ FTO Q9C0B1 1/20 0.41
▸ CYP1A2 P05177 4/20 0.37
▸ CYP2A6 P11509 3/20 0.37
▸ TSHR P16473 1/20 0.34
▸ HTR1B P28222 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TRPA1 O75762 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ SYK P43405 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ NPC1 O15118 1/20 0.32

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
SCHEMBL24237483 0.80 MAPT (0.44) ALKBH5FTOCYP1A2CYP2A6TSHR
SCHEMBL24237500 0.77 CYP1A2 (0.40) ALKBH5FTOCYP1A2CYP2A6TSHR
SCHEMBL21793464 0.76 ALKBH5 (0.58) ALKBH5FTOCYP1A2CYP2A6TSHR
SCHEMBL22336514 0.71 CDC25A (0.44) ALKBH5FTOCYP1A2CYP2A6TSHR
SCHEMBL13564048 0.66 ALKBH5 (0.67) ALKBH5FTOCYP1A2CYP2A6TSHR
SCHEMBL4071459 0.66 TRPA1 (0.55) CYP1A2CYP2A6TSHRHTR1BMAPT
Dimethylamine SCHEMBL6102519 0.66 TRPA1 (0.55) CYP1A2CYP2A6TSHRHTR1BMAPT
SCHEMBL40704 0.66 — —
SCHEMBL5494561 0.66 TRPA1 (0.61) CYP1A2CYP2A6TSHRHTR1BMAPT
SCHEMBL21793466 0.65 ALKBH5 (0.39) ALKBH5FTOCYP1A2CYP2A6TSHR

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-11877506-B2 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2024-01-16 — — US disclosed
US-20220037591-A1 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2022-02-03 — — 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-11877506-B2 Polycyclic aromatic compound F11, C1R, RNF31 ALKBH5 3438/4885FTO 4137/4885CYP1A2 133/4885
US-20220037591-A1 Polycyclic aromatic compound F11, C1R, RNF31 ALKBH5 3438/4885FTO 4137/4885CYP1A2 133/4885

“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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