SCHEMBL24188657

SCHEMBL24188657

Cn1nc2c(c1C(C)(C)C)c1ccccc1n2C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.44
▸ MAPT P10636 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ GABRP O00591 3/20 0.40
▸ GABRD O14764 3/20 0.40
▸ GABRA1 P14867 3/20 0.40
▸ GABRB1 P18505 3/20 0.40
▸ GABRG2 P18507 3/20 0.40
▸ GABRB3 P28472 3/20 0.40
▸ GABRA5 P31644 3/20 0.40
▸ GABRA3 P34903 3/20 0.40
▸ GABRA2 P47869 3/20 0.40
▸ GABRB2 P47870 3/20 0.40
▸ GABRA4 P48169 3/20 0.40
▸ GABRE P78334 3/20 0.40
▸ GABRA6 Q16445 3/20 0.40
▸ GABRG1 Q8N1C3 3/20 0.40
▸ GABRG3 Q99928 3/20 0.40
▸ GABRQ Q9UN88 3/20 0.40
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL24188651 0.75 GABRP (0.45) GPR3MAPTKDM4EGABRPGABRD
SCHEMBL24188661 0.70 KDM4E (0.53) GPR3MAPTKDM4EGABRPGABRD
SCHEMBL24188650 0.70 KDM4E (0.53) GPR3MAPTKDM4EGABRPGABRD
SCHEMBL13542540 0.69 GPR3 (0.52) GPR3MAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL18233735 0.69 SLC9A1 (0.39) GPR3KDM4EMEN1KMT2A
SCHEMBL28624996 0.68 GPR3 (0.50) GPR3MAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL24188656 0.68 ELANE (0.35) GPR3MAPTKDM4EALDH1A1MAPK1
SCHEMBL14584046 0.67 GPR3 (0.46) GPR3MAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL3739494 0.66 KDM4E (0.62) GPR3MAPTKDM4EGABRPGABRD
SCHEMBL2616445 0.66 SSTR4 (0.47) GPR3KDM4ENPSR1

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-20220013735-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-01-13 — — 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-20220013735-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OXA1L, ICOSLG, ODC1 GPR3 2043/4885MAPT 1937/4885KDM4E 2718/4885

“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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