SCHEMBL12500102

SCHEMBL12500102

CC(C)CCC[C@@H](CO)[C@H]1CC[C@H]2[C@@H]3CC=C4CCCC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 3/20 0.61
▸ RORC P51449 5/20 0.60
▸ OSBP P22059 4/20 0.60
▸ USP2 O75604 2/20 0.60
▸ CYP46A1 Q9Y6A2 2/20 0.60
▸ OSBP2 Q969R2 2/20 0.60
▸ LMNA P02545 1/20 0.60
▸ ABCB1 P08183 1/20 0.60
▸ NR1H3 Q13133 4/20 0.55
▸ POLA1 P09884 1/20 0.55
▸ DHCR24 Q15392 1/20 0.54
▸ GRIN1 Q05586 1/20 0.53
▸ GRIN2A Q12879 1/20 0.53
▸ NPC1L1 Q9UHC9 1/20 0.52
▸ NR1H2 P55055 1/20 0.52
▸ SRD5A1 P18405 3/20 0.52

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
SCHEMBL27526586 1.00 CYP19A1 (0.61) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL2631976 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL18409785 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL932451 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL24264118 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL24927685 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL11977916 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL14558147 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL7601730 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1
SCHEMBL14052247 0.88 USP2 (0.74) CYP19A1RORCOSBPUSP2CYP46A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9234885-B2 Methods and assays for treating filoviridae infections ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. (US) 2016-01-12 — — US disclosed
US-20140018338-A1 METHODS AND ASSAYS FOR TREATING FILOVIRIDAE INFECTIONS ALBERT EINSTEIN COLLEGE OF MEDICINE 2014-01-16 — — US disclosed
WO-2012103081-A1 METHODS AND ASSAYS FOR TREATING FILOVIRIDAE INFECTIONS ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2012-08-02 — — WO disclosed
CN-1242017-A Meiosis regulating compounds NOVO NORDISK AS (DK) 2000-01-19 — — CN disclosed
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