SCHEMBL21870523

SCHEMBL21870523

CO/C=C/c1c(-c2cccc(F)c2)ccnc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 5/20 0.40
▸ TOP2A P11388 1/20 0.39
▸ MTOR P42345 1/20 0.38
▸ NFE2L2 Q16236 1/20 0.38
▸ CDC7 O00311 1/20 0.36
▸ ROCK2 O75116 1/20 0.36
▸ MAP4K4 O95819 1/20 0.36
▸ PIM1 P11309 1/20 0.36
▸ PRKACA P17612 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ HIPK2 Q9H2X6 1/20 0.36
▸ CLK4 Q9HAZ1 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ SLC22A12 Q96S37 1/20 0.36
▸ SCN9A Q15858 5/20 0.36
▸ SCN5A Q14524 1/20 0.35
▸ PDGFRB P09619 1/20 0.35
▸ PDGFRA P16234 1/20 0.35
▸ PTGS2 P35354 1/20 0.35

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
SCHEMBL22167064 0.88 CCNT1 (0.32) NFE2L2SCN9APTGS2CCNT1CDK9
SCHEMBL23557292 0.85 ABL1 (0.41) PDGFRBPDGFRA
SCHEMBL21870515 0.84 TOP2A (0.42) TOP2ACDK2SCN9ACCNT1CDK9
SCHEMBL15856975 0.84 IKBKB (0.36) TOP2ANFE2L2MAP4K4PRKACACDK2
SCHEMBL21870524 0.81 NFE2L2 (0.42) FYNTOP2AMTORNFE2L2CDC7
SCHEMBL22167088 0.81 TGFBR1 (0.33) FYNNFE2L2CCNT1CDK9
SCHEMBL22167066 0.81 RPS6KA3 (0.31) —
SCHEMBL17347593 0.80 ERN1 (0.43) PTGS2MAPK10
SCHEMBL18647867 0.80 ERN1 (0.43) PTGS2MAPK10
SCHEMBL25669673 0.78 KDM4E (0.38) NFE2L2CDK2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11800788-B2 Organometallic compound and organic light-emitting device including i he same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-10-24 — — US disclosed
US-11800788-B2 Organometallic compound and organic light-emitting device including i he same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-10-24 — — US disclosed
EP-3842444-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2021-06-30 — — EP disclosed
US-20210193938-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-24 — — US disclosed
US-20200212319-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-07-02 — — US disclosed
US-20200111977-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-04-09 — — 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 (3 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-11800788-B2 Organometallic compound and organic light-emitting device including i he same UBE2L3, CRY1, OR10J3 FYN 4384/4885TOP2A 4004/4885MTOR 2799/4885
US-20200212319-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME OR10J3, UBE2L3, NR2E3 FYN 4023/4885TOP2A 3861/4885MTOR 3337/4885
US-20200111977-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME ORC3, ORMDL3, OR10J3 FYN 2991/4885TOP2A 4478/4885MTOR 3226/4885

“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.

Send feedback