SCHEMBL9065452

SCHEMBL9065452

O=[C]Cn1nnc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.61
TSHR P16473 2/20 0.61
NPC1 O15118 2/20 0.61
KDM4E B2RXH2 1/20 0.61
HPGD P15428 1/20 0.61
HSD17B10 Q99714 1/20 0.61
SLC9A1 P19634 8/20 0.59
GRM2 Q14416 2/20 0.56
GLA P06280 1/20 0.56
EGLN3 Q9H6Z9 1/20 0.54
MAPT P10636 1/20 0.53
MGAM O43451 1/20 0.53
AMY1A P0DUB6 1/20 0.53
GAA P10253 1/20 0.53
SI P14410 1/20 0.53
MGAM2 Q2M2H8 1/20 0.53
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 1/20 0.50
KCNMA1 Q12791 1/20 0.50
APAF1 O14727 1/20 0.50

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
SCHEMBL285179 0.81 TSHR (0.70) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL769428 0.81 RAB9A (0.61) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL30360007 0.81 TSHR (0.70) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL6736070 0.79 SLC9A1 (0.66) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL31234269 0.78 SLC9A1 (0.70) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL1774497 0.78 SLC9A1 (0.70) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL31634773 0.77 SLC9A1 (0.54) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL6006904 0.77 RPS6KA3 (0.59) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL12204523 0.76 RAB9A (1.00) RAB9ATSHRNPC1KDM4EHPGD
SCHEMBL7672465 0.76 SLC9A1 (0.68) RAB9ATSHRNPC1KDM4ESLC9A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5521318-A INTERMEDIATE FOR YELLOW PHOTOGRAPHIC COUPLER FUJI PHOTO FILM CO., LTD. (JP) 1996-05-28 US disclosed
US-4576753-A MICROBIOCIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-03-18 US disclosed
US-4472309-A ANTIMICROBIAL FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 US disclosed
US-4304718-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-12-08 US disclosed
US-4264498-A REACTED WITH AN ACID, ITS ACID HALIDE, OR ANHYDRIDE IN THE PRESENCE OF BORON TRIHALIDE AND AN ORGANIC BASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-04-28 US disclosed
US-4181800-A ANTIBIOTICS FROM SUBSTITUTED PERHYDRO-S-TRIAZINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-01-01 US disclosed