SCHEMBL11527112

SCHEMBL11527112

CCCCCCCCCCCCCCOc1ccc(C(=O)C(Oc2ccc(OC)cc2)Sc2nnnn2-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.47
▸ LMNA P02545 5/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ MAPK1 P28482 2/20 0.46
▸ TSHR P16473 5/20 0.46
▸ MAPT P10636 3/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ SMN1; SMN2 Q16637 5/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ NFKB2 Q00653 1/20 0.44
▸ RELA Q04206 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ JAK2 O60674 1/20 0.42

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
SCHEMBL11470128 0.85 ALDH1A1 (0.50) ALDH1A1LMNATSHRMAPTSMN1; SMN2
SCHEMBL11504316 0.81 TSHR (0.49) ALDH1A1LMNAMAPK1TSHRMAPT
SCHEMBL11477922 0.79 MAPT (0.73) ALDH1A1LMNAKDM4EMAPK1TSHR
SCHEMBL11525271 0.74 CYP1A2 (0.43) ALDH1A1LMNAKDM4EMAPK1TSHR
SCHEMBL10833423 0.72 ALDH1A1 (0.49) ALDH1A1LMNAMAPK1TSHRMAPT
SCHEMBL11504318 0.72 CYP1A2 (0.46) ALDH1A1LMNATSHRMAPTCYP1A2
SCHEMBL10908727 0.70 ALDH1A1 (0.61) ALDH1A1LMNAMAPK1TSHRMAPT
SCHEMBL6510534 0.69 ALDH1A1 (0.63) ALDH1A1LMNAMAPK1TSHRMAPT
SCHEMBL24210232 0.68 CYP1A2 (0.56) ALDH1A1LMNAKDM4EMAPK1TSHR
SCHEMBL11515258 0.68 ALDH1A1 (0.53) ALDH1A1LMNAKDM4EMAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4157916-A Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1979-06-12 — — US disclosed
US-4121934-A COUPLING COMPOUND WHICH FORMS COLORLESS COMPOUND WITH OXIDIZED DEVELOPER FUJI PHOTO FILM CO., LTD. (JP) 1978-10-24 — — US disclosed
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