SCHEMBL10028103

SCHEMBL10028103

O=C(c1ccccc1)c1cc2ccc3oc4cc(C(=O)c5ccccc5)cc5ccc6oc(c1)c2c3-c6c54

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
ALDH1A1 P00352 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HPGD P15428 2/20 0.40
MIF P14174 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CA12 O43570 2/20 0.40
CA9 Q16790 2/20 0.40
CNR2 P34972 3/20 0.39
CTNNB1 P35222 1/20 0.39
WNT3A P56704 1/20 0.39
SRD5A2 P31213 1/20 0.39

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
SCHEMBL10028192 0.88 MEN1 (0.46) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL10028077 0.71 AKR1C3 (0.43) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL9718973 0.69 MEN1 (0.81) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL31619506 0.69 ATM (0.57) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL16233176 0.69 MEN1 (0.45) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL3349765 0.69 ATM (0.84) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL133982 0.69 ATM (0.84) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL13045507 0.69 ATM (0.84) KMT2AMEN1NPC1RAB9ATSHR
SCHEMBL124894 0.66 MEN1 (0.75) KMT2AMEN1NPC1RAB9AMAPK1
Benzophenone SCHEMBL28127869 0.66 ALDH1A1 (0.88) KMT2AMEN1NPC1RAB9ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046915-B1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-12-02 EP disclosed
US-8114531-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-02-14 US disclosed
US-8114531-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-02-14 US disclosed
US-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-01-21 US disclosed
US-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-01-21 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-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, SOD1, SLC40A1 KMT2A 3703/4885MEN1 1130/4885NPC1 1014/4885

“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.