SCHEMBL8724486

SCHEMBL8724486

C=CC(C)(O)C(C)(C)C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL28598425 0.85 ALOX15 (0.36)
Ammonia Solution, Strong SCHEMBL3363274 0.76 ALOX15 (0.32)
SCHEMBL8665784 0.73
SCHEMBL1548339 0.72
SCHEMBL129187 0.72
Ammonia Solution, Strong SCHEMBL766637 0.69
SCHEMBL6028003 0.69
Tert-Butanol SCHEMBL15510638 0.69 ALOX15 (0.36)
SCHEMBL28497774 0.69
Ammonia Solution, Strong SCHEMBL11504576 0.69

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4111915-A LITHIUM ALKENOXIDES IN PREPARATION OF FUNCTIONAL LIQUID CONJUGATED DIENE POLYMERS PHILLIPS PETROLEUM COMPANY (US) 1978-09-05 US claimed
US-20170227846-A1 Photopatternable Compositions and Methods of Fabricating Transistor Devices Using Same USINVEST LLC 2017-08-10 US disclosed
US-9704997-B2 Photopatternable materials and related electronic devices and methods FLEXTERRA, INC. (US) 2017-07-11 US disclosed
US-20170104080-A1 Curable Polymeric Materials and Their Use for Fabricating Electronic Devices USINVEST LLC 2017-04-13 US disclosed
US-20160190337-A1 Photopatternable Materials and Related Electronic Devices and Methods USINVEST LLC 2016-06-30 US disclosed
US-9190493-B2 Photopatternable materials and related electronic devices and methods POLYERA CORPORATION (US) 2015-11-17 US disclosed
US-20150021597-A1 Photopatternable Materials and Related Electronic Devices and Methods USINVEST LLC 2015-01-22 US disclosed
US-5728857-A POLYMERIZATION CATALYSTS FOR PRODUCING POLYVINYL CHLORIDE HAVING A HIGH QUALITY IN A HIGH YIELD AND IN A SHORT TIME SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-03-17 US disclosed
US-4464370-A Cyclohexene containing morpholines and fungicidal use BASF AKTIENGESELLSCHAFT (DE) 1984-08-07 US disclosed
EP-0066196-A1 Cyclohexane derivatives, their preparation and fungicides containing them BASF Aktiengesellschaft (DE) 1982-12-08 EP disclosed
US-4111915-A LITHIUM ALKENOXIDES IN PREPARATION OF FUNCTIONAL LIQUID CONJUGATED DIENE POLYMERS PHILLIPS PETROLEUM COMPANY (US) 1978-09-05 US disclosed