SCHEMBL21670508

SCHEMBL21670508

COc1ccc(-c2cc(-c3ccc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)cc3)cc(-c3ccc(OC)cc3OC)n2)c(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 6/20 0.43
▸ CYP1B1 Q16678 6/20 0.43
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ NFKB1 P19838 3/20 0.41
▸ NFKB2 Q00653 3/20 0.41
▸ RELA Q04206 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ TLR9 Q9NR96 3/20 0.41
▸ TLR7 Q9NYK1 2/20 0.41
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2E1 P05181 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2C8 P10632 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP2A6 P11509 2/20 0.40

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
SCHEMBL30525980 1.00 CYP1A1 (0.43) CYP1A1CYP1B1MEN1KMT2ANFKB1
SCHEMBL21670601 0.86 CYP1A1 (0.46) CYP1A1CYP1B1MEN1KMT2ANFKB1
SCHEMBL30526030 0.86 CYP1A1 (0.46) CYP1A1CYP1B1MEN1KMT2ANFKB1
SCHEMBL8196608 0.86 MEN1 (0.52) CYP1A1CYP1B1MEN1KMT2ANFKB1
SCHEMBL21670550 0.86 FGFR2 (0.45) CYP1A1CYP1B1MEN1KMT2ANFKB1
SCHEMBL30525978 0.86 FGFR2 (0.45) CYP1A1CYP1B1MEN1KMT2ANFKB1
SCHEMBL21670588 0.84 LMNA (0.43) MEN1KMT2ASMN1; SMN2MAPTCYP3A4
SCHEMBL30525960 0.84 LMNA (0.43) MEN1KMT2ASMN1; SMN2MAPTCYP3A4
SCHEMBL21670533 0.84 LMNA (0.43) MEN1KMT2ASMN1; SMN2MAPTCYP3A4
SCHEMBL30526006 0.84 LMNA (0.43) MEN1KMT2ASMN1; SMN2MAPTCYP3A4

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
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