SCHEMBL23348455

SCHEMBL23348455

Cc1cc(C)c(-c2ccc3c(c2)c2ccc(-c4c(C)cc(C)cc4C)cc2n3-c2cccc(-n3c4ccc(-c5c(C)cc(C)cc5C)cc4c4ccc(-c5c(C)cc(C)cc5C)cc43)c2-c2ccc(C#N)cc2)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.37
PTGER4 P35408 1/20 0.34
ALDH1A1 P00352 2/20 0.32
ATM Q13315 1/20 0.32
EGLN2 Q96KS0 2/20 0.32
AR P10275 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
KDM1A O60341 6/20 0.31
CYP2A6 P11509 1/20 0.31
NSD2 O96028 1/20 0.31
RORC P51449 1/20 0.30
BRD4 O60885 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
SCHEMBL23348523 0.89 CHEK1 (0.36) CHEK1PTGER4EGLN2KDM1A
SCHEMBL23348415 0.87 ALDH1A1 (0.34) CHEK1PTGER4ALDH1A1ATMAR
SCHEMBL23348226 0.87 SMN1; SMN2 (0.36) ALDH1A1
SCHEMBL23348253 0.87 EGLN2 (0.38) EGLN2
SCHEMBL25659019 0.86 PTGER4 (0.40) CHEK1PTGER4ALDH1A1ATMEGLN2
SCHEMBL21928627 0.85 CHEK1 (0.40) CHEK1EGLN2ARTNKS2KDM1A
SCHEMBL24737225 0.85 CHEK1 (0.42) CHEK1EGLN2ARTNKS2KDM1A
SCHEMBL23348252 0.84 EGLN2 (0.32) EGLN2
SCHEMBL21928625 0.84 CHEK1 (0.39) CHEK1PTGER4ALDH1A1ATMEGLN2
SCHEMBL23348466 0.84 CHEK1 (0.37) CHEK1PTGER4ATMAR

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-20210139425-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-05-13 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-20210139425-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CCND2, CCND1, CRY1 CHEK1 303/4885PTGER4 2435/4885ALDH1A1 88/4885

“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.