SCHEMBL26412294

SCHEMBL26412294

N#Cc1ccc2c(c1)sc1c(-c3ccccn3)ccc(-c3ccccc3)c12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 10/20 0.39
▸ METAP2 P50579 1/20 0.38
▸ METAP1 P53582 1/20 0.38
▸ TGFBR1 P36897 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ LIMK1 P53667 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ CYP19A1 P11511 1/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ ABCG2 Q9UNQ0 1/20 0.35
▸ CLK4 Q9HAZ1 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
SCHEMBL22316601 0.81 GRM5 (0.41) GRM5METAP2METAP1TGFBR1LIMK1
SCHEMBL31663603 0.77 GRM5 (0.49) GRM5METAP2METAP1TGFBR1PTGDR2
SCHEMBL22316604 0.74 GRM5 (0.41) GRM5METAP2METAP1TGFBR1KDM4E
SCHEMBL22316976 0.74 GRM5 (0.42) GRM5METAP2METAP1TGFBR1PTGDR2
SCHEMBL22316605 0.73 MIF (0.41) METAP1TGFBR1KDM4ESMN1; SMN2HSD17B10
SCHEMBL24496743 0.72 LIMK1 (0.41) GRM5TGFBR1LIMK1SMN1; SMN2
SCHEMBL21236529 0.71 ABCG2 (0.43) HSD17B10ABCG2CLK4
SCHEMBL21236530 0.70 ABCG2 (0.42) HSD17B10ABCG2CLK4
SCHEMBL17116410 0.70 METAP2 (0.34) GRM5METAP2TGFBR1LIMK1HSD17B10
SCHEMBL17037097 0.69 LIMK1 (0.51) LIMK1CYP19A1CYP11B1CYP11B2

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-11785839-B2 Organic light-emitting materials containing cyano-substituted ligand Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-10-10 — — 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-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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