SCHEMBL2880693

SCHEMBL2880693

O=C1NC(=O)/C(=C\c2ccc3occc3c2)S1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.57
▸ PIK3CA P42336 1/20 0.57
▸ PIK3CG P48736 1/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ IGF1R P08069 1/20 0.55
▸ GSK3B P49841 2/20 0.55
▸ PIM1 P11309 9/20 0.54
▸ PIM2 Q9P1W9 9/20 0.54
▸ PIM3 Q86V86 1/20 0.54
▸ AKR1B1 P15121 3/20 0.53
▸ HPGD P15428 2/20 0.53
▸ MAOA P21397 2/20 0.53
▸ MAOB P27338 2/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ CISD1 Q9NZ45 2/20 0.52
▸ CYP2A6 P11509 1/20 0.51

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
SCHEMBL6794569 1.00 RAB9A (0.57) RAB9APIK3CAPIK3CGNPC1IGF1R
SCHEMBL2880695 1.00 RAB9A (0.57) RAB9APIK3CAPIK3CGNPC1IGF1R
SCHEMBL16762276 0.88 PIM1 (0.64) RAB9APIK3CAPIK3CGPIM1CISD1
SCHEMBL16762271 0.88 PIM1 (0.64) RAB9APIK3CAPIK3CGPIM1CISD1
SCHEMBL16762261 0.88 MEN1 (0.55) RAB9APIK3CAPIK3CGNPC1IGF1R
SCHEMBL16762274 0.88 PIM1 (0.64) RAB9APIK3CAPIK3CGPIM1CISD1
SCHEMBL16762263 0.88 MEN1 (0.55) RAB9APIK3CAPIK3CGNPC1IGF1R
SCHEMBL27985070 0.84 CLK1 (0.46) RAB9APIK3CAPIK3CGNPC1IGF1R
SCHEMBL2882186 0.78 IGF1R (0.59) RAB9APIK3CAPIK3CGNPC1IGF1R
SCHEMBL2882182 0.78 IGF1R (0.59) RAB9APIK3CAPIK3CGNPC1IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 — — US claimed
US-20090042773-A1 P13 kinase gamma inhibitors for the treatment of anaemia MERCK SERONO SA (CH) 2009-02-12 — — US claimed
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2006-06-08 — — US claimed
US-20050222225-A1 Use of compounds for increasing spermatozoa motility APPLIED RESEARCH SYSTEMS ARS HOLDING NV (NL) 2005-10-06 — — US claimed
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 — — US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 — — US disclosed
US-20080306057-A1 P13K Inhibitors for the Treatment of Endometriosis LABORATORIES SERONO SA (CH) 2008-12-11 — — US disclosed
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2006-06-08 — — US disclosed
US-20050222225-A1 Use of compounds for increasing spermatozoa motility APPLIED RESEARCH SYSTEMS ARS HOLDING NV (NL) 2005-10-06 — — US disclosed
EP-1531813-A1 USE OF COMPOUNDS FOR INCREASING SPERMATOZOA MOTILITY Applied Research Systems ARS Holding N.V. (AN) 2005-05-25 — — EP disclosed
WO-2004006916-A1 USE OF COMPOUNDS FOR INCREASING SPERMATOZOA MOTILITY APPLIED RESEARCH SYSTEMS ARS HOLDING NV (AN) 2004-01-22 — — 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 (5 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-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES ZAP70, BRCA1, ZYX RAB9A 1515/4885PIK3CA 619/4885PIK3CG 1265/4885
US-20090042773-A1 P13 kinase gamma inhibitors for the treatment of anaemia PDPK1, PRKD3, PRKD1 RAB9A 1524/4885PIK3CA 17/4885PIK3CG 52/4885
US-20050222225-A1 Use of compounds for increasing spermatozoa motility CATSPER1, PI4KB, MAN2B2 RAB9A 1737/4885PIK3CA 130/4885PIK3CG 110/4885
US-20080306057-A1 P13K Inhibitors for the Treatment of Endometriosis PDPK1, PIK3R4, MAP3K3 RAB9A 1949/4885PIK3CA 29/4885PIK3CG 52/4885
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives BRCA1, ZAP70, F13B RAB9A 1504/4885PIK3CA 559/4885PIK3CG 1318/4885

“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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