SCHEMBL21670554

SCHEMBL21670554

CCCCCCOc1ccc(-c2cc(-c3ccc(Nc4ccccc4)cc3)cc(-c3ccc(OCCCCCC)cc3OCCCCCC)n2)c(OCCCCCC)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 6/20 0.43
LTB4R Q15722 2/20 0.41
PDK2 Q15119 1/20 0.40
PTPN1 P18031 1/20 0.40
FAAH O00519 6/20 0.40
RARB P10826 3/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39

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
SCHEMBL30525990 1.00 PTPN11 (0.43) PTPN11LTB4RPDK2PTPN1FAAH
SCHEMBL30526014 0.99 PTPN11 (0.42) PTPN11LTB4RPDK2PTPN1FAAH
SCHEMBL21670599 0.99 PTPN11 (0.42) PTPN11LTB4RPDK2PTPN1FAAH
SCHEMBL30525977 0.97 CYP2D6 (0.40) PTPN11LTB4RPTPN1
SCHEMBL21670573 0.97 CYP2D6 (0.40) PTPN11LTB4RPTPN1
SCHEMBL21670564 0.92 MAPT (0.41)
SCHEMBL30525984 0.92 MAPT (0.41)
SCHEMBL29048610 0.90 PTPN11 (0.43) PTPN11PTPN1FAAHRARB
SCHEMBL21670534 0.89 PTPN11 (0.41) PTPN11RARB
SCHEMBL30525994 0.89 PTPN11 (0.41) PTPN11RARB

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