SCHEMBL4907759

SCHEMBL4907759

Cc1ccc(Cn2c(-c3ccc(-c4ccc5ccn(C(=O)OC(C)(C)C)c5c4)cc3)cc(C(F)(F)F)c(C#N)c2=O)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 6/20 0.43
NR1H3 Q13133 5/20 0.43
RXRA P19793 3/20 0.43
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 3/20 0.32
GAA P10253 2/20 0.32
GLA P06280 1/20 0.32
ATM Q13315 1/20 0.32
ACLY P53396 1/20 0.32
TNKS O95271 2/20 0.31
TNKS2 Q9H2K2 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP2C9 P11712 2/20 0.30
CYP2C19 P33261 2/20 0.30
RXFP1 Q9HBX9 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL4899624 0.95 NR1H2 (0.41) NR1H2NR1H3RXRAMAPTPOLB
SCHEMBL4897626 0.91 RXRA (0.46) NR1H2NR1H3RXRAMAPTPOLB
SCHEMBL4897419 0.90 NR1H2 (0.42) NR1H2NR1H3RXRAMAPTPOLB
SCHEMBL5598041 0.84 NR1H2 (0.40) NR1H2NR1H3RXRAMAPTPOLB
SCHEMBL5795184 0.81 RXRA (0.45) NR1H2NR1H3RXRAMAPTPOLB
SCHEMBL2263648 0.80 RXRA (0.44) NR1H2NR1H3RXRAMEN1KMT2A
SCHEMBL2266112 0.80 NR1H2 (0.56) NR1H2NR1H3RXRAMAPTPOLB
SCHEMBL4904761 0.80 NR1H2 (0.52) NR1H2NR1H3RXRAMAPTPOLB
SCHEMBL5598162 0.79 NR1H2 (0.40) NR1H2NR1H3RXRAMAPTPOLB
SCHEMBL2262884 0.79 NR1H2 (0.52) NR1H2NR1H3RXRAMAPTPOLB

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-20080119488-A1 Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2008-05-22 US claimed
US-20080119488-A1 Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2008-05-22 US disclosed
US-20080119488-A1 Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2008-05-22 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-20080119488-A1 Modulators Of Nuclear Receptors NR1H2, NR0B1, NR1H3 NR1H2 1/4885NR1H3 3/4885RXRA 20/4885

“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.