SCHEMBL21670567

SCHEMBL21670567

CCOc1ccc(-c2cc(-c3ccc(Nc4c(C)cc(C)cc4C)cc3)cc(-c3ccc(OCC)cc3OCC)n2)c(OCC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RAPGEF4 Q8WZA2 2/20 0.40
MAPT P10636 3/20 0.39
POLB P06746 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
RAD52 P43351 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
SLC2A1 P11166 2/20 0.38
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALOX5 P09917 1/20 0.36
AGPAT2 O15120 2/20 0.36

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
SCHEMBL29048615 0.89 RAPGEF4 (0.38) KDM4ELMNATP53SMN1; SMN2RAPGEF4
SCHEMBL30525968 0.89 LMNA (0.44) KDM4ELMNATP53SMN1; SMN2MAPT
SCHEMBL21670537 0.89 LMNA (0.44) KDM4ELMNATP53SMN1; SMN2MAPT
SCHEMBL21670520 0.88 AGPAT2 (0.46) RAPGEF4AGPAT2
SCHEMBL31368585 0.88 AGPAT2 (0.46) RAPGEF4AGPAT2
SCHEMBL21670518 0.87 KDM4E (0.46) KDM4ELMNATP53SMN1; SMN2MAPT
SCHEMBL30525957 0.87 KDM4E (0.46) KDM4ELMNATP53SMN1; SMN2MAPT
SCHEMBL21670522 0.87 MAPT (0.42) KDM4ELMNATP53SMN1; SMN2MAPT
SCHEMBL21670516 0.87 ENPP3 (0.46) KDM4ETP53RAPGEF4MAPTPOLB
SCHEMBL30525991 0.87 ENPP3 (0.46) KDM4ETP53RAPGEF4MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3608386-B1 REVERSIBLY THERMOCHROMIC COMPOSITION, AND REVERSIBLY THERMOCHROMIC MICROCAPSULE PIGMENT HAVING SAME ENCLOSED THEREIN PILOT INK CO LTD (JP) 2025-02-19 EP disclosed
CN-110446770-B Reversible thermochromic composition and reversible thermochromic microcapsule pigment containing the same 百乐墨水株式会社 2023-08-08 CN disclosed
US-11060018-B2 Reversibly thermochromic composition and reversibly thermochromic microcapsule pigment encapsulating the same THE PILOT INK CO., LTD. (JP) 2021-07-13 US disclosed
US-20200048542-A1 REVERSIBLY THERMOCHROMIC COMPOSITION AND REVERSIBLY THERMOCHROMIC MICROCAPSULE PIGMENT ENCAPSULATING THE SAME THE PILOT INK CO., LTD. (JP) 2020-02-13 US disclosed
EP-3608386-A1 REVERSIBLY THERMOCHROMIC COMPOSITION, AND REVERSIBLY THERMOCHROMIC MICROCAPSULE PIGMENT HAVING SAME ENCLOSED THEREIN The Pilot Ink Co., Ltd (JP) 2020-02-12 EP disclosed