SCHEMBL5527248

SCHEMBL5527248

ON1c2ccccc2C=CC1CCl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 3/20 0.36
SCN4A P35499 1/20 0.34
SCN5A Q14524 1/20 0.34
SCN9A Q15858 1/20 0.34
P2RX4 Q99571 8/20 0.34
P2RX1 P51575 3/20 0.34
P2RX3 P56373 3/20 0.34
P2RX7 Q99572 2/20 0.34
PTBP1 P26599 1/20 0.33
MTNR1A P48039 2/20 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
SCHEMBL28886571 0.82 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL28016737 0.76 KMT2A (0.39) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL31558693 0.73 MEN1 (0.40) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL2402302 0.73 MEN1 (0.40) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL28017429 0.72 MEN1 (0.39) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL27779918 0.71 MAPK1 (0.42) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL28254814 0.68 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL7529541 0.66 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL22202241 0.66 SMN1; SMN2 (0.43) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1
SCHEMBL3625895 0.64 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2TSHRMAPK1NPSR1

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-20070244128-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-10-18 US disclosed
US-20070225285-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-09-27 US disclosed
US-20070219206-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-09-20 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 (3 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-20070225285-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 ALDH1A1 1358/4885SMN1; SMN2 4174/4885TSHR 4215/4885
US-20070244128-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 ALDH1A1 1358/4885SMN1; SMN2 4174/4885TSHR 4215/4885
US-20070219206-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 ALDH1A1 1358/4885SMN1; SMN2 4174/4885TSHR 4215/4885

“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.