SCHEMBL18820353

SCHEMBL18820353

CCCCc1ccc(/N=C2\CCCCCN2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NISCH Q9Y2I1 1/20 0.41
▸ HTR1D P28221 1/20 0.41
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ PSEN1 P49768 1/20 0.39
▸ PSEN2 P49810 1/20 0.39
▸ APH1B Q8WW43 1/20 0.39
▸ NCSTN Q92542 1/20 0.39
▸ APH1A Q96BI3 1/20 0.39
▸ PSENEN Q9NZ42 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CA2 P00918 2/20 0.36
▸ CA1 P00915 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.35
▸ AURKA O14965 1/20 0.35
▸ MLNR O43193 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL18819704 0.98 NISCH (0.42) NISCHHTR1DCYP3A4CYP2D6CYP2C9
SCHEMBL11183418 0.80 NISCH (0.44) NISCHHTR1DCYP3A4CYP2D6CYP2C9
SCHEMBL7332320 0.78 NISCH (0.38) NISCHALDH1A1HPGDSMN1; SMN2NPC1
SCHEMBL7332315 0.78 NISCH (0.38) NISCHALDH1A1HPGDSMN1; SMN2NPC1
SCHEMBL16886019 0.78 NISCH (0.38) NISCHALDH1A1HPGDSMN1; SMN2NPC1
SCHEMBL16892098 0.77 APOBEC3A (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL11187718 0.76 NISCH (0.46) NISCHHTR1DCYP3A4CYP2D6CYP2C9
SCHEMBL11181538 0.76 CYP3A4 (0.43) NISCHHTR1DCYP3A4CYP2D6CYP2C9
SCHEMBL7355484 0.75 PSEN1 (0.39) NISCHHTR1DPSEN1PSEN2APH1B
SCHEMBL7355487 0.75 PSEN1 (0.39) NISCHHTR1DPSEN1PSEN2APH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3368643-B1 LUBRICATING OIL COMPOSITIONS CONTAINING AMIDINE ANTIOXIDANTS CHEVRON ORONITE CO (US) 2019-11-20 — — EP disclosed
US-9752092-B2 Lubricating oil compositions containing amidine antioxidants CHEVRON ORONITE COMPANY LLC (US) 2017-09-05 — — US disclosed
US-20170121625-A1 LUBRICATING OIL COMPOSITIONS CONTAINING AMIDINE ANTIOXIDANTS CHEVRON ORONITE COMPANY LLC 2017-05-04 — — US disclosed
Send feedback