SCHEMBL4174207

SCHEMBL4174207

CCc1c(C)c2c3c(C(F)(F)F)cc(=O)n(CCOCCOCCOC4CCCCO4)c3ccc2n1CCOCCOCCOC1CCCCO1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.36
P2RX3 P56373 5/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CNR1 P21554 2/20 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
SCHEMBL4171499 0.81 AR (0.49) ARP2RX3
SCHEMBL4187294 0.80 AR (0.49) ARP2RX3MEN1KMT2A
SCHEMBL4187064 0.80 AR (0.49) ARP2RX3MEN1KMT2A
SCHEMBL4169288 0.70 AR (0.39) ARP2RX3MEN1KMT2A
SCHEMBL4177007 0.70 AR (0.39) ARP2RX3MEN1KMT2A
SCHEMBL4174159 0.70 AR (0.39) ARP2RX3MEN1KMT2A
SCHEMBL4186335 0.69 AR (0.48) AR
SCHEMBL4176622 0.67 P2RX3 (0.36) P2RX3MEN1KMT2AL3MBTL1KDM4C
SCHEMBL20547967 0.64 CYP1A2 (0.47) MEN1KMT2AMAPTKDM4CNPC1
SCHEMBL20548002 0.64 CYP1A2 (0.47) MEN1KMT2AMAPTKDM4CNPC1

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
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 US claimed
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 US disclosed
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 US disclosed
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 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-20090227571-A1 Androgen Receptor Modulator Compounds and Methods AR, NR5A1, ESRRA AR 1/4885P2RX3 1640/4885POLB 2927/4885

“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.