SCHEMBL25751933

SCHEMBL25751933

c1ccc2c(c1)sc1cnc(-n3c4ccccc4c4ccccc43)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.44
▸ GABRP O00591 1/20 0.43
▸ GABRD O14764 1/20 0.43
▸ GABRA1 P14867 1/20 0.43
▸ GABRB1 P18505 1/20 0.43
▸ GABRG2 P18507 1/20 0.43
▸ GABRB3 P28472 1/20 0.43
▸ GABRA5 P31644 1/20 0.43
▸ GABRA3 P34903 1/20 0.43
▸ GABRA2 P47869 1/20 0.43
▸ GABRB2 P47870 1/20 0.43
▸ GABRA4 P48169 1/20 0.43
▸ GABRE P78334 1/20 0.43
▸ GABRA6 Q16445 1/20 0.43
▸ GABRG1 Q8N1C3 1/20 0.43
▸ GABRG3 Q99928 1/20 0.43
▸ GABRQ Q9UN88 1/20 0.43
▸ MAPT P10636 4/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ HPGD P15428 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
SCHEMBL10451378 0.91 GABRP (0.38) GPR3GABRPGABRDGABRA1GABRB1
SCHEMBL24631964 0.89 GABRP (0.42) GPR3GABRPGABRDGABRA1GABRB1
SCHEMBL9891019 0.88 KDM4E (0.39) GPR3GABRPGABRDGABRA1GABRB1
SCHEMBL25751942 0.88 GPR3 (0.44) GPR3GABRPGABRDGABRA1GABRB1
SCHEMBL25751962 0.86 KDM4E (0.37) GPR3GABRPGABRDGABRA1GABRB1
SCHEMBL13245816 0.86 GABRP (0.33) GPR3GABRPGABRDGABRA1GABRB1
SCHEMBL17124614 0.86 ATM (0.41) GPR3GABRPGABRDGABRA1GABRB1
SCHEMBL13245671 0.83 LIMK1 (0.33) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL23177537 0.82 GABRP (0.32) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25751954 0.81 ALDH1A1 (0.34) ALDH1A1L3MBTL1KDM4EATM

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-20230217823-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-07-06 — — US disclosed
US-20230217823-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-07-06 — — 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 (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-20230217823-A1 ORGANIC ELECTROLUMINESCENT DEVICE LEF1, EPB41L2, CTNNBL1 GPR3 2474/4885GABRP 4835/4885GABRD 4854/4885

“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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