SCHEMBL21670535

SCHEMBL21670535

CCCCCCOc1ccc(-c2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)cc(-c3ccc(OCCCCCC)cc3OCCCCCC)n2)c(OCCCCCC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 3/20 0.42
▸ HRH3 Q9Y5N1 3/20 0.40
▸ ATP4A P20648 2/20 0.39
▸ ATP4B P51164 2/20 0.39
▸ GCGR P47871 1/20 0.39
▸ LTB4R Q15722 1/20 0.39
▸ RARB P10826 3/20 0.38
▸ THRA P10827 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ CYP2D6 P10635 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP19A1 P11511 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CYP3A4 P08684 1/20 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
SCHEMBL21670591 1.00 PTPN11 (0.42) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL30526011 1.00 PTPN11 (0.42) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL30526026 1.00 PTPN11 (0.42) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL21670543 0.99 HRH3 (0.40) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL30526022 0.99 HRH3 (0.40) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL21670511 0.99 HRH3 (0.40) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL30525981 0.99 HRH3 (0.40) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL21670525 0.97 ATP4A (0.41) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL21670510 0.97 ATP4A (0.41) PTPN11HRH3ATP4AATP4BGCGR
SCHEMBL30526042 0.97 ATP4A (0.41) PTPN11HRH3ATP4AATP4BGCGR

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
Send feedback