SCHEMBL16011025

SCHEMBL16011025

CC(C)C1=C[C@H](O)[C@H]2C(C)(C)CCC[C@@]12C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 2/20 0.37
▸ SOD1 P00441 1/20 0.36
▸ CYP3A4 P08684 5/20 0.35
▸ USP2 O75604 4/20 0.35
▸ MAPT P10636 4/20 0.35
▸ TP53 P04637 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HSP90AA1 P07900 1/20 0.35
▸ EP300 Q09472 1/20 0.34
▸ KARS1 Q15046 2/20 0.33
▸ HPGD P15428 3/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ FDPS P14324 3/20 0.31
▸ BCL9 O00512 3/20 0.30
▸ CTNNB1 P35222 3/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ RXRA P19793 1/20 0.30

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
SCHEMBL16010808 1.00 CYP19A1 (0.37) CYP19A1SOD1CYP3A4USP2MAPT
SCHEMBL16010811 1.00 CYP19A1 (0.37) CYP19A1SOD1CYP3A4USP2MAPT
SCHEMBL14880080 0.77 TRPA1 (0.34) CYP19A1SOD1CYP3A4MAPTEP300
SCHEMBL11451547 0.77 TRPA1 (0.34) CYP19A1SOD1CYP3A4MAPTEP300
SCHEMBL14882179 0.77 TRPA1 (0.34) CYP19A1SOD1CYP3A4MAPTEP300
SCHEMBL18290373 0.70 EP300 (0.66) CYP19A1SOD1CYP3A4USP2MAPT
SCHEMBL14879678 0.64 EP300 (0.40) CYP19A1CYP3A4USP2MAPTTP53
SCHEMBL14880141 0.64 EP300 (0.40) CYP19A1CYP3A4USP2MAPTTP53
SCHEMBL14882079 0.63 EP300 (0.54) CYP19A1CYP3A4USP2MAPTTP53
SCHEMBL16010952 0.63 EP300 (0.54) CYP19A1CYP3A4USP2MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2768307-B1 OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE BIKAM PHARMACEUTICALS INC (US) 2020-03-18 — — EP disclosed
US-20170137398-A1 OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE BIKAM PHARMACEUTICALS, INC. (US) 2017-05-18 — — US disclosed
US-9499464-B2 Opsin-binding ligands, compositions and methods of use BIKAM PHARMACEUTICALS, INC. (US) 2016-11-22 — — US disclosed
US-20140256782-A1 Opsin-Binding Ligands, Compositions and Methods of Use BIKAM PHARMACEUTICALS, INC. (US) 2014-09-11 — — 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-20170137398-A1 OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE CRYAB, CRYAA, PDE6C CYP19A1 4114/4885SOD1 3456/4885CYP3A4 4427/4885
US-20140256782-A1 Opsin-Binding Ligands, Compositions and Methods of Use CRYAB, PDE6C, CRYAA CYP19A1 3985/4885SOD1 3310/4885CYP3A4 4349/4885

“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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