SCHEMBL20440811

SCHEMBL20440811

COc1cc(CC(O)C2=C(C)CCCC2(C)C)ccc1C(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 1/20 0.38
▸ FOS P01100 1/20 0.36
▸ TTR P02766 1/20 0.36
▸ JUN P05412 1/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ HSD17B1 P14061 1/20 0.36
▸ HSD17B2 P37059 1/20 0.36
▸ ALOX15 P16050 3/20 0.34
▸ ALOX12 P18054 3/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ PDCD1 Q15116 1/20 0.34
▸ ACE2 Q9BYF1 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.34
▸ LDHA P00338 1/20 0.33

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
SCHEMBL20440806 0.80 ADRB2 (0.38) —
SCHEMBL14992642 0.78 RARB (0.32) ALOX15
SCHEMBL20440792 0.78 GAA (0.40) HIF1AGAAMAPTPDCD1ACE2
SCHEMBL14992777 0.74 POLB (0.36) —
SCHEMBL20440810 0.73 DUSP3 (0.38) —
SCHEMBL14993194 0.71 AR (0.37) —
SCHEMBL14993790 0.70 HTR2A (0.47) GAAMAPT
SCHEMBL20440799 0.70 ACE2 (0.44) ALOX15PDCD1ACE2CD274
SCHEMBL13548297 0.70 FOS (0.50) FOSTTRJUNNR3C1HSD17B1
SCHEMBL20440802 0.69 GAA (0.40) HIF1AGAAMAPTPDCD1ACE2

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-10040749-B2 Opsin-binding ligands, compositions and methods of use BIKAM PHARMACEUTICALS INC. (US) 2018-08-07 — — US claimed
US-10040749-B2 Opsin-binding ligands, compositions and methods of use BIKAM PHARMACEUTICALS INC. (US) 2018-08-07 — — US disclosed
US-10040749-B2 Opsin-binding ligands, compositions and methods of use BIKAM PHARMACEUTICALS INC. (US) 2018-08-07 — — 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-10040749-B2 Opsin-binding ligands, compositions and methods of use CRYAB, CRYAA, PDE6C HIF1A 4133/4885FOS 3289/4885TTR 332/4885

“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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