SCHEMBL18686100

SCHEMBL18686100

c1ccc(-n2c(-c3ccc(N4c5ccccc5Cc5ccccc54)cc3)nc3cc4sc(-c5ccc(N6c7ccccc7Cc7ccccc76)cc5)nc4cc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
PKM P14618 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
APP P05067 7/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
SIRT2 Q8IXJ6 2/20 0.34
SIRT1 Q96EB6 2/20 0.34
GRIA1 P42261 1/20 0.33
CACNG8 Q8WXS5 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
SCHEMBL18680476 0.94 PKM (0.36) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL18680475 0.94 PKM (0.35) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL17283294 0.92 NPC1 (0.41) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL17283324 0.91 ESR1 (0.41) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL17283292 0.87 SMN1; SMN2 (0.38) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL17283295 0.86 SMN1; SMN2 (0.37) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL17283326 0.86 ESR1 (0.37) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL17283327 0.85 ESR1 (0.37) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL17283290 0.84 SMN1; SMN2 (0.36) SMN1; SMN2PKMKMT2ANPC1RAB9A
SCHEMBL18680477 0.83 ESR1 (0.35) SMN1; SMN2PKMKMT2ANPC1RAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170092874-A1 Fluorescent Organic Light Emitting Elements Having High Efficiency BASF SE (DE) 2017-03-30 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-20170092874-A1 Fluorescent Organic Light Emitting Elements Having High Efficiency TEAD1, TEAD2, TEAD4 SMN1; SMN2 2504/4885PKM 3224/4885KMT2A 3925/4885

“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.