SCHEMBL23344276

SCHEMBL23344276

CC(=O)C1CCC2C3CC[C@@H]4C[C@](C)(O)CC[C@@H]4C3CC[C@]12C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRP O00591 19/20 1.00
GABRD O14764 19/20 1.00
GABRA1 P14867 19/20 1.00
GABRB1 P18505 19/20 1.00
GABRG2 P18507 19/20 1.00
GABRB3 P28472 19/20 1.00
GABRA5 P31644 19/20 1.00
GABRA3 P34903 19/20 1.00
GABRA2 P47869 19/20 1.00
GABRB2 P47870 19/20 1.00
GABRA4 P48169 19/20 1.00
GABRE P78334 19/20 1.00
GABRA6 Q16445 19/20 1.00
GABRG1 Q8N1C3 19/20 1.00
GABRG3 Q99928 19/20 1.00
GABRQ Q9UN88 19/20 1.00
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61

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
SCHEMBL16188640 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL14871146 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL14871130 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7351621 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL3124023 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL23346583 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL19650972 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL23468933 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL21091386 1.00 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29904068 0.94 GABRA1 (0.88) GABRPGABRDGABRA1GABRB1GABRG2

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-20210139530-A1 STEROID DERIVATIVE REGULATORS, METHOD FOR PREPARING THE SAME, AND USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-05-13 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-20210139530-A1 STEROID DERIVATIVE REGULATORS, METHOD FOR PREPARING THE SAME, AND USES THEREOF GABRD, GABRR1, GABRA1 GABRP 24/4885GABRD 1/4885GABRA1 3/4885

“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.