SCHEMBL12397902

SCHEMBL12397902

C[C@@H]1C/C(=C/C=C2\CCC[C@]3(C)C([C@H](C)/C=C/[C@H](C)C(C)(C)O)CC[C@@H]23)C[C@@H](O)C1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 12/20 0.61
▸ NR1I2 O75469 2/20 0.56
▸ PGR P06401 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ HDAC3 O15379 1/20 0.54
▸ HDAC2 Q92769 1/20 0.54
▸ HDAC6 Q9UBN7 1/20 0.54
▸ HTR1A P08908 1/20 0.53
▸ ADORA3 P0DMS8 1/20 0.53
▸ SLC6A2 P23975 1/20 0.53
▸ SLC6A4 P31645 1/20 0.53
▸ ADRA1A P35348 1/20 0.53
▸ PTGS2 P35354 1/20 0.53

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
SCHEMBL12047755 1.00 VDR (0.61) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL12464943 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL12535671 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL12397908 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL25447329 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL24066861 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL17354891 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL6945983 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL21836180 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A
Paricalcitol SCHEMBL14491013 0.94 VDR (0.68) VDRNR1I2PGRMEN1KMT2A

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-9212136-B2 Methods for producing paricalcitol AZAD PHARMACEUTICALS INGREDIENTS AG (CH) 2015-12-15 — — US disclosed
US-20110184199-A1 Methods For Producing Paricalcitol AZAD PHARMA AG (CH) 2011-07-28 — — 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-20110184199-A1 Methods For Producing Paricalcitol CYP2R1, PTH1R, CYP24A1 VDR 18/4885NR1I2 4034/4885PGR 3674/4885

“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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