SCHEMBL21670516

SCHEMBL21670516

CCOc1ccccc1-c1cc(-c2ccc(Nc3c(C)cc(C)cc3C)cc2)cc(-c2ccccc2OCC)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.46
ENPP1 P22413 1/20 0.46
RAPGEF4 Q8WZA2 4/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
ATM Q13315 1/20 0.40
AGPAT2 O15120 3/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
DHFR P00374 1/20 0.38
TP53 P04637 1/20 0.38
PDE10A Q9Y233 1/20 0.38
PTPRC P08575 1/20 0.38
MAPK14 Q16539 1/20 0.38
NR3C1 P04150 1/20 0.38
CETP P11597 1/20 0.38
KDM1A O60341 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL30525991 1.00 ENPP3 (0.46) ENPP3ENPP1RAPGEF4KMT2AMEN1
SCHEMBL29048658 0.89 MAPK10 (0.44) ENPP3ENPP1RAPGEF4AGPAT2ADORA2A
SCHEMBL21670546 0.88 ENPP3 (0.55) ENPP3ENPP1KMT2AMEN1ATM
SCHEMBL30526033 0.87 ENPP3 (0.47) ENPP3ENPP1KMT2AMEN1ATM
SCHEMBL21670514 0.87 ENPP3 (0.47) ENPP3ENPP1KMT2AMEN1ATM
SCHEMBL21670567 0.87 KDM4E (0.41) RAPGEF4KMT2AAGPAT2TP53KDM4E
SCHEMBL31368585 0.86 AGPAT2 (0.46) RAPGEF4AGPAT2
SCHEMBL21670520 0.86 AGPAT2 (0.46) RAPGEF4AGPAT2
SCHEMBL21670536 0.86 AGPAT2 (0.48) ENPP3ENPP1KMT2AMEN1ATM
SCHEMBL30525972 0.86 AGPAT2 (0.48) ENPP3ENPP1KMT2AMEN1ATM

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 4 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
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