SCHEMBL6908997

SCHEMBL6908997

Cc1cccc(C2=CC(=O)C(C)(C)c3cc4ccc(-c5ccc(C(=O)O)cc5)cc4cc32)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RARA P10276 12/20 0.54
RARB P10826 11/20 0.54
RARG P13631 11/20 0.54
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 1/20 0.39
NR2E1 Q9Y466 1/20 0.39
PGR P06401 1/20 0.39
RXRA P19793 4/20 0.39
RXRB P28702 3/20 0.39
DHODH Q02127 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
SCHEMBL6548975 0.89 RARA (0.43) RARARARBRARGPGR
SCHEMBL980736 0.73 DHODH (0.55) RARARARBRARGRXRARXRB
SCHEMBL2610268 0.73 RXRA (0.69) RARARARBRARGRXRARXRB
SCHEMBL31331712 0.73 RXRA (0.69) RARARARBRARGRXRARXRB
SCHEMBL6907265 0.71 RARB (0.64) RARARARBRARGNR2E1PGR
SCHEMBL8706490 0.71 RARB (0.85) RARARARBRARGNR2E1RXRA
SCHEMBL8706311 0.70 RARB (1.00) RARARARBRARGNR2E1RXRA
Benzoic Acid SCHEMBL28361078 0.67 KMO (0.66) RXRARXRBDHODH
SCHEMBL31266609 0.67 RARB (1.00) RARARARBRARGMEN1THRB
SCHEMBL3453631 0.67 RARB (1.00) RARARARBRARGMEN1THRB

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-20040122080-A1 Synergist combinations of retinoid receptor ligands and selected cytotoxic agents for treatment of cancer BRISTOL-MYERS SQUIBB COMPANY 2004-06-24 US disclosed
CN-1498105-A Synergistic combination system for treating cancer comprising a retinoid receptor ligand and a selected cytotoxic agent ����˹�ж�-����˹˹������˾ 2004-05-19 CN 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-20040122080-A1 Synergist combinations of retinoid receptor ligands and selected cytotoxic agents for treatment of cancer RARA, RARG, RARB RARA 1/4885RARB 3/4885RARG 2/4885

“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.