SCHEMBL9614871

SCHEMBL9614871

CC1C[C@@]2(C)C(CC[C@]23CCC(=O)O3)C2CCC3=CC(=O)CCC3C12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 11/20 0.60
▸ AR P10275 7/20 0.51
▸ NR3C2 P08235 1/20 0.45
▸ CYP3A4 P08684 3/20 0.44
▸ NR3C1 P04150 2/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ HSD17B2 P37059 1/20 0.44
▸ LMNA P02545 2/20 0.44
▸ ABCB11 O95342 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ ESR1 P03372 1/20 0.44
▸ SHBG P04278 1/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ SLC6A4 P31645 1/20 0.44

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
SCHEMBL782987 1.00 PGR (0.60) PGRARNR3C2CYP3A4NR3C1
SCHEMBL8011421 0.83 PGR (0.62) PGRARNR3C2CYP3A4NR3C1
SCHEMBL13768846 0.83 PGR (0.62) PGRARNR3C2CYP3A4NR3C1
SCHEMBL9019789 0.82 PGR (0.69) PGRARCYP3A4NR3C1
SCHEMBL8425124 0.79 PGR (0.62) PGRARNR3C2CYP3A4NR3C1
SCHEMBL8719020 0.78 PGR (0.59) PGRARNR3C2CYP3A4NR3C1
SCHEMBL12949428 0.78 AR (0.66) PGRARNR3C2CYP3A4NR3C1
SCHEMBL11424896 0.77 PGR (0.70) PGRARCYP3A4NR3C1CHRM2
SCHEMBL8423621 0.77 PGR (0.63) PGRARNR3C2CYP3A4NR3C1
SCHEMBL13768465 0.76 PGR (0.62) PGRARNR3C2CYP3A4NR3C1

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
EP-0491803-A1 IMPLANTABLE DELIVERY DISPENSER. ALZA CORP (US) 1992-07-01 — — EP claimed
WO-1991004016-A1 IMPLANTABLE DELIVERY DISPENSER ALZA CORPORATION (US) 1991-04-04 — — WO claimed
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