SCHEMBL7413767

SCHEMBL7413767

COc1ccc(Cn2cnc(N)c3nc(C(C)C)nc2-3)cc1OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 7/20 0.46
MAPK1 P28482 2/20 0.46
HSD17B10 Q99714 1/20 0.46
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41

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
Hydrochloric Acid SCHEMBL7205781 0.99 CSF1R (0.46) CSF1RMAPK1HSD17B10KDM4EALDH1A1
SCHEMBL7380421 0.90 CSF1R (0.43) CSF1RMAPK1HSD17B10KDM4EALDH1A1
SCHEMBL7375371 0.90 QPCT (0.45) CSF1RKDM4ELMNAHTT
SCHEMBL6675823 0.89 MAPK1 (0.46) CSF1RMAPK1HSD17B10KDM4EALDH1A1
Hydrochloric Acid SCHEMBL7864182 0.86 PDE4A (0.45) CSF1RMAPK1HSD17B10KDM4EALDH1A1
SCHEMBL7379984 0.85 MAPK1 (0.46) CSF1RMAPK1HSD17B10KDM4EALDH1A1
Hydrochloric Acid SCHEMBL7208744 0.85 MAPK1 (0.45) CSF1RMAPK1HSD17B10KDM4EALDH1A1
Hydrochloric Acid SCHEMBL7863467 0.84 CSF1R (0.44) CSF1RMAPK1HSD17B10KDM4EALDH1A1
SCHEMBL7739711 0.83 CSF1R (0.45) CSF1RMAPK1HSD17B10KDM4EALDH1A1
Hydrochloric Acid SCHEMBL7205601 0.83 CSF1R (0.44) CSF1RMAPK1HSD17B10KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002541078-A 2002-12-03 JP claimed
EP-1169321-A4 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY EURO CELTIQUE SA (LU) 2002-10-30 EP claimed
US-6413975-B1 DISEASES WITH HIGH LEVELS OF INFLAMMATORY CYTOKINES; ASTHMA; ALLERGIES; INFLAMMATION; DEPRESSION; ALZHEIMER'S DISEASE; VASCULAR AND MULTI-IN-FARCT DEMENTIA EURO-CELTIQUE, S.A. (LU) 2002-07-02 US claimed
EP-1169321-A2 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY Euro-Celtique S.A. (LU) 2002-01-09 EP claimed
WO-2000059449-A2 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY EURO-CELTIQUE S.A. (LU) 2000-10-12 WO claimed
US-6319928-B1 ASTHMA, ALLERGIES, INFLAMMATION,DEPRESSION, DEMENTIA, ALZHEIMER'S DISEASE, VASCULAR AND MULTI-IN-FARCT DEMENTIA AND DISEASE CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS TREATMENT; EFFICIENCY AND SELECTIVITY EURO-CELTIQUE, S.A. (LU) 2001-11-20 US disclosed
US-6294541-B1 ENZYME INHIBITORS USING PURINE COMPOUNDS AS ANTIHISTAMINES EURO-CELTIQUE S.A. (LU) 2001-09-25 US disclosed