SCHEMBL23790699

SCHEMBL23790699

CCn1c2ccccc2c2c1c1c3ccccc3n(CC)c1c1c3cc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)ccc3n(CC)c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 4/20 0.47
TSPO P30536 1/20 0.47
PTGER4 P35408 9/20 0.43
RAC2 P15153 1/20 0.43
RAC3 P60763 1/20 0.43
CDC42 P60953 1/20 0.43
RAC1 P63000 1/20 0.43
PTGES O14684 1/20 0.42
KDM4E B2RXH2 2/20 0.40
RCE1 Q9Y256 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
HBB P68871 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL23790653 0.96 NPY5R (0.48) NPY5RTSPOPTGER4RAC2RAC3
SCHEMBL23790652 0.89 NPY5R (0.46) NPY5RTSPOPTGER4RAC2RAC3
SCHEMBL25491307 0.83 TSPO (0.50) NPY5RTSPOPTGER4RAC2RAC3
SCHEMBL16865778 0.82 NPY5R (0.58) NPY5RTSPOPTGER4RAC2RAC3
SCHEMBL12034124 0.80 NPY5R (0.56) NPY5RTSPOPTGER4RAC2RAC3
SCHEMBL12034062 0.80 NPY5R (0.56) NPY5RTSPOPTGER4RAC2RAC3
SCHEMBL23790854 0.80 TSPO (0.37) NPY5RTSPOPTGER4MEN1ALDH1A1
SCHEMBL23790651 0.79 L3MBTL1 (0.41) TSPOPTGER4KDM4EMEN1ALDH1A1
SCHEMBL23790668 0.79 KDM4E (0.43) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL24667559 0.77 KDM4E (0.63) NPY5RTSPOPTGER4RAC2RAC3

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-11818953-B2 Heterocyclic compound, organic light-emitting device including heterocyclic compound, and electronic apparatus including organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-14 US disclosed
US-11818953-B2 Heterocyclic compound, organic light-emitting device including heterocyclic compound, and electronic apparatus including organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-14 US disclosed
US-20210280798-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-09-09 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-11818953-B2 Heterocyclic compound, organic light-emitting device including heterocyclic compound, and electronic apparatus including organic light-emitting device CYP2E1, CRY1, CYP1A1 NPY5R 3438/4885TSPO 1407/4885PTGER4 996/4885

“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.