SCHEMBL27441809

SCHEMBL27441809

Cc1coc2cc(C(C)C)c(F)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.41
▸ KDM4E B2RXH2 6/20 0.41
▸ HSD17B10 Q99714 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ POLB P06746 3/20 0.34
▸ KCNA3 P22001 3/20 0.33
▸ KCNA2 P16389 1/20 0.33
▸ KCNA1 Q09470 1/20 0.33
▸ ALDH1A2 O94788 1/20 0.33
▸ ALDH2 P05091 1/20 0.33
▸ ALDH1B1 P30837 1/20 0.33
▸ ALDH1A3 P47895 1/20 0.33
▸ PFKFB3 Q16875 2/20 0.33
▸ MEN1 O00255 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31

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
SCHEMBL5986942 0.79 ALDH1A1 (0.47) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL5987722 0.75 ALDH1A1 (0.47) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL19248240 0.73 ALDH1A1 (0.57) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL17324284 0.71 ALDH1A1 (0.41) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL19248241 0.71 ALDH1A1 (0.67) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL17321061 0.70 ALDH1A1 (0.43) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL12546006 0.70 CHRNB2 (0.39) CYP1A2IKBKETBK1
SCHEMBL8404362 0.69 ALDH1A1 (0.53) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL12051645 0.69 EIF4A3 (0.38) POLBLMNAEIF4A3
SCHEMBL17321031 0.69 ALOX15 (0.34) —

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-20240216357-A1 POLYCYCLIC COMPOUND AND APPLICATION THEREOF SICHUAN HUIYU PHARMACEUTICAL CO., LTD. (CN) 2024-07-04 — — US disclosed
US-20240216357-A1 POLYCYCLIC COMPOUND AND APPLICATION THEREOF SICHUAN HUIYU PHARMACEUTICAL CO., LTD. (CN) 2024-07-04 — — 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-20240216357-A1 POLYCYCLIC COMPOUND AND APPLICATION THEREOF KDM1A, TET1, KDM3A ALDH1A1 460/4885KDM4E 40/4885HSD17B10 401/4885

“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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