SCHEMBL5458409

SCHEMBL5458409

Fc1ccccc1Cc1ncc(Cl)[c]c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.39
ALDH1A1 P00352 4/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TAAR1 Q96RJ0 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 1/20 0.34
NPC1 O15118 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ABL1 P00519 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL5469027 0.84 AR (0.41) ARALDH1A1KMT2AMEN1HTR2C
SCHEMBL5466965 0.81 AR (0.39) ARALDH1A1RXFP1HTR2CHTR2B
SCHEMBL17436168 0.68 HDAC6 (0.43) ARALDH1A1KMT2AMEN1HTR2C
SCHEMBL1862185 0.68 CYP1A2 (0.41) ALDH1A1KMT2AMEN1TAAR1L3MBTL1
SCHEMBL5410799 0.68 AR (0.41) ARALDH1A1KMT2AMEN1RXFP1
SCHEMBL3301625 0.66 TAAR1 (0.59) ARALDH1A1TAAR1L3MBTL1KDM4E
SCHEMBL20543464 0.66 SMN1; SMN2 (0.40) ARALDH1A1KMT2AMEN1RXFP1
SCHEMBL3802061 0.65 TDP1 (0.38) ARALDH1A1KMT2AMEN1HTR2C
SCHEMBL11195639 0.64 TAAR1 (0.50) ALDH1A1KMT2AMEN1TAAR1L3MBTL1
SCHEMBL9485705 0.63 NPC1 (0.49) ARALDH1A1HTR2CHTR2BTP53

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-20070093531-A1 Novel hydroxyindoles, their use as inhibitors of phosphodiesterase 4, and processes for preparing them ELBION AG 2007-04-26 US disclosed
US-7166637-B2 Hydroxyindoles, their use as inhibitors of phosphodiesterase 4, and processes for preparing them ELBION AG (DE) 2007-01-23 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-20070093531-A1 Novel hydroxyindoles, their use as inhibitors of phosphodiesterase 4, and processes for preparing them PDE4B, PDE4A, PDE4D AR 4648/4885ALDH1A1 1815/4885KMT2A 2518/4885

“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.