SCHEMBL6037050

SCHEMBL6037050

CC(C=CC(=O)N1CCOc2cc3c(cc21)CC=CC3)=CC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.35
RXRA P19793 3/20 0.34
RARA P10276 2/20 0.34
RARB P10826 2/20 0.34
RARG P13631 2/20 0.34
KMT2A Q03164 2/20 0.33
TP53 P04637 2/20 0.32
MAPT P10636 2/20 0.32
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
EGFR P00533 4/20 0.31
ERBB2 P04626 4/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
MEN1 O00255 1/20 0.31
THRB P10828 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
SCHEMBL6037048 1.00 NOTUM (0.35) NOTUMRXRARARARARBRARG
SCHEMBL8308414 0.85 ALDH1A1 (0.43) NOTUMKMT2AMAPTMEN1THRB
SCHEMBL4970588 0.80 RXRA (0.48) RXRARARARARBRARGRXRB
SCHEMBL4970582 0.80 RXRA (0.48) RXRARARARARBRARGRXRB
SCHEMBL4969115 0.65 NOTUM (0.61) NOTUMKMT2AMAPTTHRB
SCHEMBL4969919 0.65 NOTUM (0.61) NOTUMKMT2AMAPTTHRB
SCHEMBL4969128 0.65 NOTUM (0.61) NOTUMKMT2AMAPTTHRB
SCHEMBL6037039 0.64 RXRA (0.49) RXRARARARARBRARGRXRB
SCHEMBL8308616 0.63 RXRA (0.48) RXRARARARARBRARGRXRB
SCHEMBL7669724 0.62 RXRA (0.37) RXRARARARARBRARGRXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0933350-A1 Tricyclic retinoids, methods for their production and use LIGAND PHARMACEUTICALS INCORPORATED (US) 1999-08-04 EP claimed
WO-1996020914-A1 TRICYCLIC RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE LIGAND PHARMACEUTICALS INCORPORATED (US) 1996-07-11 WO claimed
US-20060030597-A1 Method of inhibiting angiogenesis GERRITSEN MARY E 2006-02-09 US disclosed
US-20010036955-A1 Method of inhibiting angiogenesis GENENTECH, INC. 2001-11-01 US disclosed
EP-0933351-A1 Tricyclic retinoids, methods for their production and use LIGAND PHARMACEUTICALS INCORPORATED (US) 1999-08-04 EP disclosed
EP-0933350-A1 Tricyclic retinoids, methods for their production and use LIGAND PHARMACEUTICALS INCORPORATED (US) 1999-08-04 EP disclosed
EP-0800504-A1 TRICYCLIC RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE LIGAND PHARMACEUTICALS, INC. (US) 1997-10-15 EP disclosed
WO-1996020914-A1 TRICYCLIC RETINOIDS, METHODS FOR THEIR PRODUCTION AND USE LIGAND PHARMACEUTICALS INCORPORATED (US) 1996-07-11 WO 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-20060030597-A1 Method of inhibiting angiogenesis PPARG, PPARA, RXRG NOTUM 3927/4885RXRA 6/4885RARA 21/4885
US-20010036955-A1 Method of inhibiting angiogenesis PPARG, PPARA, RXRG NOTUM 3927/4885RXRA 6/4885RARA 21/4885

“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.