Isopropylbenzene

Isopropylbenzene

SCHEMBL28328641

CC(C)c1ccccc1.F[P-](F)(F)(F)(F)F.[Fe].[Fe]C1=CC=CC1.[H+]

nearest known ligand 0.30

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.30

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
Isopropylbenzene SCHEMBL28233311 0.98 CYP2D6 (0.31) CYP2D6
Isopropylbenzene SCHEMBL23327458 0.97 CYP2D6 (0.32) CYP2D6
Isopropylbenzene SCHEMBL27987213 0.92 CYP2D6 (0.34) CYP2D6
Isopropylbenzene SCHEMBL1406995 0.90 CYP2D6 (0.35) CYP2D6
Naphthalene SCHEMBL28401700 0.81 CYP2A6 (0.32)
Benzene SCHEMBL28186963 0.81
Isopropylbenzene SCHEMBL28266523 0.78 CYP2D6 (0.34) CYP2D6
Isopropylbenzene SCHEMBL19460008 0.78 CYP2D6 (0.32) CYP2D6
Isopropylbenzene SCHEMBL19460007 0.78 CYP2D6 (0.32) CYP2D6
Isopropylbenzene SCHEMBL21628025 0.77 TAAR1 (0.41) CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110337189-A Circuit board etching method 惠州市星之光科技有限公司 2019-10-15 CN disclosed