SCHEMBL29694175

SCHEMBL29694175

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2/C(=C/C=C3C[C@@H](O)C(CCCO)[C@H](O)C3)CCC[C@]12C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 12/20 0.76
▸ MAPT P10636 3/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.65
▸ SREBF1 P36956 1/20 0.65
▸ NR1I2 O75469 1/20 0.64
▸ ABCB11 O95342 1/20 0.64
▸ GC P02774 1/20 0.64
▸ PGR P06401 1/20 0.64
▸ ADORA3 P0DMS8 1/20 0.64
▸ RXRA P19793 1/20 0.64
▸ CHRM3 P20309 1/20 0.64
▸ CNR1 P21554 1/20 0.64
▸ SLC6A2 P23975 1/20 0.64
▸ HTR2C P28335 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ AGTR1 P30556 1/20 0.64
▸ SLC6A4 P31645 1/20 0.64
▸ ADRA1A P35348 1/20 0.64
▸ PTGS2 P35354 1/20 0.64
▸ OPRD1 P41143 1/20 0.64

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
SCHEMBL14107799 0.96 VDR (0.77) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL23359143 0.93 VDR (0.81) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL23359142 0.93 VDR (0.81) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL13993786 0.90 VDR (0.80) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL6259692 0.89 VDR (0.78) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL6364731 0.89 VDR (0.78) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL8003696 0.89 VDR (0.78) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL8003699 0.89 VDR (0.78) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL19461421 0.88 VDR (0.82) VDRMAPTSMN1; SMN2SREBF1NR1I2
SCHEMBL15371115 0.88 VDR (0.82) VDRMAPTSMN1; SMN2SREBF1NR1I2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4570321-A2 JAK INHIBITOR WITH A VITAMIN D ANALOG FOR TREATMENT OF SKIN DISEASES Incyte Corporation (US) 2025-06-18 — — EP disclosed
US-20250049817-A1 JAK INHIBITOR WITH A VITAMIN D ANALOG FOR TREATMENT OF SKIN DISEASES INCYTE CORP (US) 2025-02-13 — — US disclosed
US-12005067-B2 JAK inhibitor with a vitamin D analog for treatment of skin diseases INCYTE CORPORATION (US) 2024-06-11 — — US disclosed
CN-117157080-A JAK inhibitors containing vitamin D analogues for the treatment of skin disorders 因赛特公司 2023-12-01 — — CN disclosed
EP-4255442-A1 JAK INHIBITOR WITH A VITAMIN D ANALOG FOR TREATMENT OF SKIN DISEASES Incyte Corporation (US) 2023-10-11 — — EP disclosed
WO-2023068322-A1 CD RING SIDE CHAIN-SUBSTITUTED VITAMIN D DERIVATIVE 学校法人帝京大学 2023-04-27 — — WO disclosed
US-20220202834-A1 JAK INHIBITOR WITH A VITAMIN D ANALOG FOR TREATMENT OF SKIN DISEASES INCYTE CORPORATION 2022-06-30 — — US disclosed
WO-2022120131-A1 JAK INHIBITOR WITH A VITAMIN D ANALOG FOR TREATMENT OF SKIN DISEASES INCYTE CORPORATION (US) 2022-06-09 — — WO 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 (3 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-12005067-B2 JAK inhibitor with a vitamin D analog for treatment of skin diseases JAK3, IL23R, JAK1 VDR 4/4885MAPT 1458/4885SMN1; SMN2 4723/4885
US-20250049817-A1 JAK INHIBITOR WITH A VITAMIN D ANALOG FOR TREATMENT OF SKIN DISEASES JAK3, IL23R, JAK1 VDR 4/4885MAPT 1458/4885SMN1; SMN2 4723/4885
US-20220202834-A1 JAK INHIBITOR WITH A VITAMIN D ANALOG FOR TREATMENT OF SKIN DISEASES JAK3, IL23R, JAK1 VDR 4/4885MAPT 1458/4885SMN1; SMN2 4723/4885

“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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