SCHEMBL231992

SCHEMBL231992

CN(c1ccc(Cl)cc1)c1ccc(C(=O)c2cc(C(=O)O)cc(C(=O)Nc3ccccc3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.50
KCNK3 O14649 2/20 0.48
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 3/20 0.46
LMNA P02545 3/20 0.46
HTT P42858 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
NOD2 Q9HC29 1/20 0.46
MAPT P10636 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
GAA P10253 1/20 0.46
CNR1 P21554 1/20 0.46
SERPINE1 P05121 1/20 0.45
HSD17B10 Q99714 2/20 0.45
ALOX15 P16050 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SIRT2 Q8IXJ6 1/20 0.44

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
SCHEMBL231986 0.90 RAB9A (0.47) KCNK3NPC1RAB9AMEN1KMT2A
SCHEMBL13155760 0.88 KCNK3 (0.46) KCNK3NPC1RAB9AMEN1KMT2A
SCHEMBL2743185 0.87 MAPK13 (0.47) NPC1RAB9AALDH1A1LMNAHTT
SCHEMBL250983 0.86 LTC4S (0.56)
SCHEMBL230136 0.85 SRD5A2 (0.51) NPC1RAB9AALDH1A1LMNAHTT
SCHEMBL232051 0.84 USP2 (0.53) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL232237 0.83 SRD5A2 (0.56) NPC1RAB9AALDH1A1LMNAL3MBTL1
SCHEMBL234174 0.82 SRD5A2 (0.51) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL2743184 0.81 SRD5A2 (0.47) NPC1ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL232375 0.81 LTC4S (0.46) NPC1RAB9AMEN1KMT2AALDH1A1

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-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
US-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 US disclosed
US-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors BIOLIPOX AB (SW) 2012-01-05 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-20120004228-A1 Bis Aromatic Compounds for Use as LTC4 Synthase Inhibitors LTC4S, LTB4R2, LTB4R FFAR1 1314/4885KCNK3 1573/4885NPC1 2560/4885

“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.