SCHEMBL6389672

SCHEMBL6389672

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.74
▸ NPC1L1 Q9UHC9 6/20 0.65
▸ NR1H3 Q13133 2/20 0.65
▸ CRYAB P02511 1/20 0.65
▸ HMGCR P04035 1/20 0.65
▸ ITGB3 P05106 1/20 0.65
▸ ITGAV P06756 1/20 0.65
▸ OSBP P22059 1/20 0.65
▸ RORC P51449 1/20 0.65
▸ SREBF2 Q12772 1/20 0.65
▸ OSBP2 Q969R2 1/20 0.65
▸ GRIN1 Q05586 5/20 0.58
▸ GRIN2B Q13224 5/20 0.58
▸ GRIN2A Q12879 4/20 0.58
▸ SRD5A1 P18405 3/20 0.56
▸ USP2 O75604 1/20 0.56

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
SCHEMBL6389389 0.92 NPC1L1 (0.64) PTPN1NPC1L1NR1H3CRYABHMGCR
SCHEMBL11410953 0.89 PTPN1 (0.76) PTPN1NR1H3OSBPRORCOSBP2
SCHEMBL6392384 0.87 PTPN1 (0.74) PTPN1NR1H3OSBPRORCOSBP2
SCHEMBL6388546 0.87 PTPN1 (0.74) PTPN1NR1H3OSBPRORCOSBP2
SCHEMBL27563313 0.87 PTPN1 (0.74) PTPN1NR1H3OSBPRORCOSBP2
SCHEMBL6393358 0.87 PTPN1 (0.74) PTPN1NR1H3OSBPRORCOSBP2
SCHEMBL6389412 0.87 PTPN1 (0.74) PTPN1NR1H3OSBPRORCOSBP2
SCHEMBL6393986 0.85 PTPN1 (0.77) PTPN1NR1H3OSBPRORCOSBP2
SCHEMBL6389048 0.85 PTPN1 (0.77) PTPN1NR1H3OSBPRORCOSBP2
SCHEMBL6388375 0.84 PTPN1 (0.84) PTPN1NR1H3USP2

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
US-20050004382-A1 Meiosis regulating compounds GRONDAHL CHRISTIAN (DK) 2005-01-06 — — US disclosed
US-6759400-B2 Meiosis regulating compounds NOVO NORDISK A/S (DK) 2004-07-06 — — US disclosed
EP-0946584-B1 Meiosis regulating compounds NOVO NORDISK AS (DK) 2003-04-23 — — EP disclosed
US-20030032824-A1 Meiosis regulating compounds GRONDAHL CHRISTIAN (DK) 2003-02-13 — — US disclosed
US-6486145-B2 STEROL DERIVATIVE USEFUL IN TREATMENT OF FERTILITY NOVO NORDISK A/S (DK) 2002-11-26 — — US disclosed
US-20010005757-A1 Meiosis regulating compounds GRONDAHL CHRISTIAN (DK) 2001-06-28 — — US disclosed
EP-0946584-A1 MEIOSIS REGULATING COMPOUNDS NOVO NORDISK A/S (DK) 1999-10-06 — — EP disclosed
WO-1998028323-A1 MEIOSIS REGULATING COMPOUNDS NOVO NORDISK A/S (DK) 1998-07-02 — — 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-20030032824-A1 Meiosis regulating compounds MNS1, NR5A1, NASP PTPN1 3032/4885NPC1L1 2280/4885NR1H3 340/4885
US-20010005757-A1 Meiosis regulating compounds MNS1, NR5A1, NASP PTPN1 3032/4885NPC1L1 2280/4885NR1H3 340/4885
US-20050004382-A1 Meiosis regulating compounds NASP, MNS1, NR5A1 PTPN1 3419/4885NPC1L1 2324/4885NR1H3 303/4885

“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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