SCHEMBL6942401

SCHEMBL6942401

COCCSC(F)(F)C1(c2ccc(F)cc2F)CO1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 8/20 0.34
BACE2 Q9Y5Z0 4/20 0.34
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
ALOX12 P18054 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31

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
SCHEMBL7803860 0.88 BACE1 (0.36) BACE1BACE2
SCHEMBL7804436 0.86 MAPK14 (0.35) BACE1BACE2ALDH1A1
SCHEMBL6942499 0.83 BACE1 (0.34) BACE1BACE2ALDH1A1
SCHEMBL7797796 0.82 BACE1 (0.41) BACE1
SCHEMBL7894895 0.75 BACE1 (0.34) BACE1BACE2
SCHEMBL7805235 0.69 BACE1 (0.32) BACE1BACE2
SCHEMBL9340512 0.69 HTR2A (0.38) BACE1BACE2ALDH1A1GAA
SCHEMBL7799833 0.69 HCAR3 (0.36) BACE1BACE2
SCHEMBL7808783 0.68 BACE1 (0.39) BACE1BACE2
SCHEMBL8871864 0.68 MAPT (0.42) ALDH1A1

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
EP-0899265-B1 Triazole derivatives and their use as antimycotic agents SSP CO LTD (JP) 2003-01-29 EP disclosed
EP-0814079-B1 Triazole derivative or salt thereof SS PHARMACEUTICAL CO (JP) 2001-03-28 EP disclosed
US-6063945-A FUNGICIDES SS PHARMACEUTICAL CO., LTD. (JP) 2000-05-16 US disclosed
US-6008239-A FUNGICIDES FOR THE PREVENTION AND TREATMENT OF MAMMALIAN MYCOTIC INFECTIONS SSP CO., LTD. (JP) 1999-12-28 US disclosed
US-5939448-A ANTIMYCOTIC AGENT SS PHARMACEUTICAL CO., LTD. (JP) 1999-08-17 US disclosed
EP-0899265-A1 Triazole derivatives and their use as antimycotic agents SSP Co., Ltd. (JP) 1999-03-03 EP disclosed
EP-0814079-A1 Triazole derivative or salt thereof SS PHARMACEUTICAL CO., LTD. (JP) 1997-12-29 EP disclosed