SCHEMBL13487597

SCHEMBL13487597

CC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4ccc5ccccc5n4)c4ccc(-c5cccc6ccccc56)cc34)ccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.34
RAB9A P51151 7/20 0.34
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
SMN1; SMN2 Q16637 6/20 0.34
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 4/20 0.34
AR P10275 4/20 0.34
MAPT P10636 3/20 0.34
GMNN O75496 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
PKM P14618 1/20 0.34
HPGD P15428 1/20 0.34
THPO P40225 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PTGS2 P35354 1/20 0.34
POLB P06746 2/20 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
SCHEMBL13487973 0.95 AR (0.34) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13487718 0.92 NPC1 (0.36) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13487661 0.91 NPC1 (0.36) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13487508 0.91 NPC1 (0.35) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13487621 0.89 ACACA (0.39) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL13487171 0.89 MEN1 (0.36) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13487439 0.89 AR (0.37) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13488117 0.88 PTGS2 (0.37) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13487607 0.88 NPC1 (0.36) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13487611 0.87 ESR1 (0.36) MEN1KMT2AENPP3ENPP1FLT3

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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 US disclosed
US-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 NPC1 1139/4885RAB9A 3244/4885MEN1 3017/4885

“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.