SCHEMBL22378632

SCHEMBL22378632

N#Cc1ccc2c(c1)c1cc(C#N)ccc1n2-c1ccccc1-c1cccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2C#N)c1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NR3C1 P04150 1/20 0.33
GABRA1 P14867 6/20 0.33
GABRG2 P18507 6/20 0.33
GABRB3 P28472 6/20 0.33
GABRA5 P31644 4/20 0.33
GABRA3 P34903 4/20 0.33
GABRA2 P47869 4/20 0.33
STS P08842 1/20 0.33
KDM1A O60341 1/20 0.32
ADRA2C P18825 1/20 0.32

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
SCHEMBL22377931 1.00 ALDH1A1 (0.35) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22378560 1.00 ALDH1A1 (0.35) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22378685 1.00 ALDH1A1 (0.35) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22378520 1.00 ALDH1A1 (0.35) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22378630 0.97 ALDH1A1 (0.33) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22378669 0.97 ALDH1A1 (0.33) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22377930 0.97 ALDH1A1 (0.33) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22378686 0.97 ALDH1A1 (0.33) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22379565 0.95 ALDH1A1 (0.34) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22377871 0.94 ALDH1A1 (0.36) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2

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-11800797-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-10-24 US disclosed
US-20200274074-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-08-27 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-20200274074-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CYP1A1, CRY2 ALDH1A1 19/4885LMNA 3292/4885HPGD 650/4885
US-11800797-B2 Heterocyclic compound and organic light-emitting device including the same CRY1, CYP1A1, CRY2 ALDH1A1 19/4885LMNA 3292/4885HPGD 650/4885

“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.