SCHEMBL20174714

SCHEMBL20174714

c1ccc2c(c1)-c1oc3ccccc3c1C21c2ccccc2-c2c(-c3ccc4ccc5ccccc5c4n3)cccc21

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
NTRK1 P04629 1/20 0.30
PLK3 Q9H4B4 1/20 0.30
AR P10275 1/20 0.30

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
SCHEMBL24648293 0.83 AR (0.36) MAPK1KDM4EALDH1A1MAPTHPGD
SCHEMBL20174319 0.83 KDM4E (0.36) MAPK1KMT2AKDM4EALDH1A1GAA
SCHEMBL20174230 0.80 ALDH1A1 (0.38) MAPK1KMT2AKDM4EALDH1A1GAA
SCHEMBL20174335 0.80 NPC1 (0.41) MAPK1KMT2AKDM4EALDH1A1MAPT
SCHEMBL20174281 0.80 ALOX5 (0.34) MAPK1KMT2AKDM4EALDH1A1MAPT
SCHEMBL21868320 0.79 AR (0.36) MAPK1KMT2AKDM4EALDH1A1MAPT
SCHEMBL20174337 0.78 ALDH1A1 (0.33) KMT2AKDM4EALDH1A1GAAMAPT
SCHEMBL20174351 0.77 ACACA (0.37) MAPK1KMT2AKDM4EALDH1A1MAPT
SCHEMBL20174739 0.76 NTRK1 (0.40) MAPK1KMT2AKDM4EALDH1A1MAPT
SCHEMBL29444845 0.76 AR (0.35) KMT2AKDM4EALDH1A1MAPTHPGD

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-10738034-B2 Spiro compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2020-08-11 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 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 (2 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-10738034-B2 Spiro compound and organic light-emitting device comprising same CRY1, NR2E3, ERG MAPK1 3742/4885KMT2A 1480/4885KDM4E 3633/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG MAPK1 3742/4885KMT2A 1480/4885KDM4E 3633/4885

“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.