SCHEMBL22062846

SCHEMBL22062846

CC(C)(C)c1cc2c3c(c1)n1c4ccccc4nc1n3c1nc3ccccc3n21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 6/20 0.40
TP53 P04637 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ADORA2A P29274 1/20 0.37
KDM4E B2RXH2 5/20 0.37
HPGD P15428 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 2/20 0.36
HSD17B10 Q99714 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
HTR2C P28335 1/20 0.34

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
SCHEMBL22063192 0.91 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2TP53NPC1
SCHEMBL22063194 0.88 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2TP53NPC1
SCHEMBL22062707 0.85 KIF11 (0.42) ALDH1A1LMNASMN1; SMN2TP53NPC1
SCHEMBL22063073 0.85 ALDH1A1 (0.41) ALDH1A1LMNASMN1; SMN2TP53NPC1
SCHEMBL22063070 0.84 KDM4E (0.43) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL22088726 0.84 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2TP53NPC1
SCHEMBL22063058 0.84 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2TP53NPC1
SCHEMBL22063055 0.82 SMN1; SMN2 (0.43) ALDH1A1LMNASMN1; SMN2TP53ADORA2A
SCHEMBL23763627 0.80 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2TP53NPC1
SCHEMBL22062740 0.79 KDM4E (0.41) ALDH1A1LMNASMN1; SMN2TP53ADORA2A

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-20200185620-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-06-11 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-20200185620-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE EMC2, NFE2L2, AOC2 ALDH1A1 1970/4885LMNA 1641/4885SMN1; SMN2 3979/4885

“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.