SCHEMBL22317039

SCHEMBL22317039

CC1(C)c2ccc(C#N)cc2-c2cccc(-c3ccccn3)c21

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 13/20 0.43
▸ METAP2 P50579 1/20 0.41
▸ METAP1 P53582 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ TGFBR1 P36897 1/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ FFAR1 O14842 2/20 0.38

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
SCHEMBL22317012 0.90 GRM5 (0.43) GRM5METAP2METAP1KDM4EALDH1A1
SCHEMBL22316440 0.82 TGFBR1 (0.35) GRM5KDM4EALDH1A1MAPTTSHR
SCHEMBL22316441 0.81 EGLN2 (0.36) GRM5TGFBR1FFAR1
SCHEMBL6241281 0.80 KDM4E (0.43) GRM5METAP2METAP1KDM4EALDH1A1
SCHEMBL22317011 0.80 GRIA1 (0.40) GRM5METAP1KDM4EALDH1A1MAPT
SCHEMBL26412824 0.78 GRM5 (0.42) GRM5METAP2METAP1TGFBR1
SCHEMBL22317043 0.78 PDK2 (0.43) GRM5METAP1KDM4EHTTTGFBR1
SCHEMBL24017202 0.78 METAP2 (0.49) GRM5METAP2METAP1KDM4EALDH1A1
SCHEMBL18411457 0.76 METAP2 (0.54) GRM5METAP2METAP1KDM4EALDH1A1
SCHEMBL22317041 0.75 NISCH (0.36) GRM5METAP1KDM4EALDH1A1MAPT

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-11785839-B2 Organic light-emitting materials containing cyano-substituted ligand Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-10-10 — — US disclosed
US-20200251666-A1 ORGANIC LIGHT-EMITTING MATERIALS CONTAINING CYANO-SUBSTITUTED LIGAND Beijing Summer Sprout Technology Co., Ltd. (CN) 2020-08-06 — — 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-20200251666-A1 ORGANIC LIGHT-EMITTING MATERIALS CONTAINING CYANO-SUBSTITUTED LIGAND L1CAM, CYBA, ICOSLG GRM5 1109/4885METAP2 3763/4885METAP1 4029/4885
US-11785839-B2 Organic light-emitting materials containing cyano-substituted ligand L1CAM, CYBA, ICOSLG GRM5 1109/4885METAP2 3763/4885METAP1 4029/4885

“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.

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