SCHEMBL7320882

SCHEMBL7320882

CCCCOc1ccc(-c2ccc(-c3nnc(-c4ccc(C(=O)OC)cc4)o3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.61
ALDH1A1 P00352 7/20 0.61
RAB9A P51151 6/20 0.61
KDM4E B2RXH2 6/20 0.61
NPC1 O15118 5/20 0.61
HSD17B10 Q99714 5/20 0.61
TSHR P16473 3/20 0.61
LMNA P02545 1/20 0.61
HPGD P15428 5/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
TP53 P04637 4/20 0.55
POLB P06746 1/20 0.53
RARB P10826 4/20 0.52
NR1H4 Q96RI1 1/20 0.52
ALPL P05186 1/20 0.50
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
GAA P10253 1/20 0.48

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
SCHEMBL7320106 0.97 MAPT (0.59) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7319130 0.96 RARB (0.59) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7316044 0.96 RARB (0.59) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7340342 0.95 NPC1 (0.59) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7332034 0.95 NPC1 (0.59) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7339155 0.95 RAB9A (0.61) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7324703 0.90 MAPT (0.64) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7321777 0.90 MAPT (0.64) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7324195 0.90 MAPT (0.55) MAPTALDH1A1RAB9AKDM4ENPC1
SCHEMBL7331263 0.89 MAPT (0.56) MAPTALDH1A1RAB9AKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6232290-B1 FUNGICIDES AGAINST PNEUMOCYSTIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-15 US disclosed
EP-1053247-A1 ANTIFUNGAL CYCLOHEXAPEPTIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-22 EP disclosed
WO-1999040108-A1 NEW COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-08-12 WO disclosed