SCHEMBL3473623

SCHEMBL3473623

O=C(Nc1cccc(Oc2ccccc2)c1)c1ccc(-c2cc(C(F)(F)F)nn2-c2ccccc2Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
TP53 P04637 2/20 0.51
POLB P06746 3/20 0.51
RXRA P19793 2/20 0.51
NR1H2 P55055 2/20 0.51
NR1H3 Q13133 2/20 0.51
GALK1 P51570 1/20 0.48
CASP6 P55212 1/20 0.48
MCL1 Q07820 1/20 0.48
PLEC Q15149 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
THRB P10828 3/20 0.48
HPSE Q9Y251 1/20 0.45
NR1H4 Q96RI1 1/20 0.44
TRPV1 Q8NER1 1/20 0.44
NR3C2 P08235 1/20 0.43
USP36 Q9P275 1/20 0.43

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
SCHEMBL3471242 0.93 MAPT (0.59) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3473656 0.91 MAPT (0.64) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3473536 0.91 MAPT (0.53) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3471324 0.90 MAPT (0.59) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3471319 0.89 MAPT (0.51) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3472273 0.88 MAPT (0.56) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3474587 0.88 RXRA (0.55) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3472740 0.88 MAPT (0.49) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3472421 0.88 MAPT (0.55) MAPTSMN1; SMN2TP53POLBRXRA
SCHEMBL3472362 0.87 RXRA (0.54) MAPTSMN1; SMN2TP53POLBRXRA

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-8703805-B2 Modulators of LXR EXELIXIS PATENT COMPANY LLC (US) 2014-04-22 US disclosed
US-20100331295-A1 MODULATORS OF LXR EXELIXIS, INC. (US) 2010-12-30 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-20100331295-A1 MODULATORS OF LXR NR1H2, NR1H3, NR1H4 MAPT 4737/4885SMN1; SMN2 4666/4885TP53 4318/4885

“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.