SCHEMBL27696703

SCHEMBL27696703

C=C(C=Cc1ccccc1)c1ccccc1.[SiH4].[Ti]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1B1 Q16678 8/20 0.53
▸ MAPT P10636 7/20 0.53
▸ MAOB P27338 4/20 0.53
▸ LMNA P02545 3/20 0.53
▸ PLIN1 O60240 2/20 0.53
▸ RECQL P46063 2/20 0.53
▸ PLIN5 Q00G26 2/20 0.53
▸ ABHD5 Q8WTS1 2/20 0.53
▸ BCHE P06276 2/20 0.53
▸ TNFRSF1A P19438 2/20 0.53
▸ ACHE P22303 1/20 0.53
▸ ALDH1A1 P00352 4/20 0.48
▸ HDAC3 O15379 2/20 0.48
▸ HDAC4 P56524 2/20 0.48
▸ HDAC1 Q13547 2/20 0.48
▸ HDAC2 Q92769 2/20 0.48
▸ HDAC8 Q9BY41 2/20 0.48
▸ HDAC6 Q9UBN7 2/20 0.48
▸ F3 P13726 2/20 0.48
▸ CYP1A2 P05177 2/20 0.48

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
SCHEMBL28860296 0.98 CYP1B1 (0.55) CYP1B1MAPTMAOBLMNAPLIN1
SCHEMBL6394932 0.96 CYP1B1 (0.57) CYP1B1MAPTMAOBLMNAPLIN1
SCHEMBL3233560 0.96 CYP1B1 (0.57) CYP1B1MAPTMAOBLMNAPLIN1
SCHEMBL6368627 0.84 CYP1B1 (0.62) CYP1B1MAPTMAOBLMNAPLIN1
SCHEMBL19139548 0.84 HDAC2 (0.49) CYP1B1MAPTMAOBLMNAPLIN1
SCHEMBL12948676 0.82 MAPT (0.53) CYP1B1MAPTMAOBLMNAPLIN1
SCHEMBL20244293 0.80 MAPT (0.69) CYP1B1MAPTMAOBLMNAPLIN1
SCHEMBL7622260 0.78 MAOB (0.50) CYP1B1MAPTMAOBBCHEALDH1A1
SCHEMBL30688107 0.77 — —
SCHEMBL19141838 0.76 HDAC3 (0.42) CYP1B1MAPTMAOBLMNAPLIN1

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
CN-109952324-B Blocked multi-or double-headed compositions suitable for chain shuttling and methods of making the same 陶氏环球技术有限责任公司 2023-06-09 — — CN disclosed
CN-115260366-A Catalyst system for forming multi-block copolymers 陶氏环球技术有限责任公司 2022-11-01 — — CN disclosed
CN-104892814-B The method of selective polymerization modifying agent 陶氏环球技术有限责任公司 2017-11-10 — — CN disclosed
CN-101142247-A Pseudo-block copolymers and methods of using chain shuttling agents DOW GLOBAL TECHNOLOGIES INC (US) 2008-03-12 — — CN disclosed
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