SCHEMBL21965360

SCHEMBL21965360

CC(C)Oc1cc2ccccc2cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.51
GABRD O14764 2/20 0.51
GABRA1 P14867 2/20 0.51
GABRB1 P18505 2/20 0.51
GABRG2 P18507 2/20 0.51
GABRB3 P28472 2/20 0.51
GABRA5 P31644 2/20 0.51
GABRA3 P34903 2/20 0.51
GABRA2 P47869 2/20 0.51
GABRB2 P47870 2/20 0.51
GABRA4 P48169 2/20 0.51
GABRE P78334 2/20 0.51
GABRA6 Q16445 2/20 0.51
GABRG1 Q8N1C3 2/20 0.51
GABRG3 Q99928 2/20 0.51
GABRQ Q9UN88 2/20 0.51
CYP1A2 P05177 2/20 0.48
CYP2A6 P11509 1/20 0.48
PDPK1 O15530 1/20 0.44
NPC1 O15118 2/20 0.42

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
SCHEMBL28033597 0.85 CYP1A2 (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL18318244 0.79 GABRA1 (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL30746959 0.78 KDM4E (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL1536432 0.78 KDM4E (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL11883542 0.77 CYP1A2 (0.52) CYP1A2CYP2A6PDPK1NPC1RAB9A
SCHEMBL28033593 0.76 GABRA1 (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL3372681 0.74 CYP1A2 (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6971528 0.74 CYP1A2 (0.48) CYP1A2CYP2A6PDPK1NPC1RAB9A
SCHEMBL14248268 0.73 KDM4E (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL13291032 0.73 CYP1A2 (0.48) CYP1A2CYP2A6PDPK1NPC1RAB9A

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-20200140456-A1 N/O-LINKED DEGRONS AND DEGRONIMERS FOR PROTEIN DEGRADATION C4 THERAPEUTICS, INC. (US) 2020-05-07 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-20200140456-A1 N/O-LINKED DEGRONS AND DEGRONIMERS FOR PROTEIN DEGRADATION CRBN, CBL, STUB1 GABRP 2213/4885GABRD 885/4885GABRA1 1294/4885

“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.