Isopropylbenzene

Isopropylbenzene

SCHEMBL5162171

CC(C)c1ccccc1.[CaH2]

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 4/20 0.48
▸ KDM4E B2RXH2 2/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ ADRA2C P18825 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ DPP4 P27487 2/20 0.45
▸ F2 P00734 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ MIF P14174 2/20 0.42

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 SCHEMBL11254813 0.97 — —
Isopropylbenzene SCHEMBL27727769 0.97 TAAR1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL3672803 0.97 TAAR1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL87809 0.97 TAAR1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL6568 0.97 — —
Isopropylbenzene SCHEMBL8431863 0.97 TAAR1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL23421101 0.93 ADRA2C (0.52) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL105799 0.93 TAAR1 (0.48) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL120302 0.93 ALDH1A1 (0.50) TAAR1KDM4EADRA2AADRA2CCYP2D6
Isopropylbenzene SCHEMBL7041369 0.93 TAAR1 (0.48) TAAR1KDM4EADRA2AADRA2CCYP2D6

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112545901-B One-part dental adhesive composition 株式会社松风 2024-03-22 — — CN disclosed
CN-112553012-A Laundry detergent and cleaning compositions comprising polymers containing carboxyl groups 宝洁公司 2021-03-26 — — CN disclosed
CN-104603254-B The laundry detergent compositions and cleaning compositions of polymer comprising carboxyl group 宝洁公司 2018-06-05 — — CN disclosed
CN-104769094-B What can especially be applied in combination with powder or particulate composition has the visual contrast particle attractive in appearance of the water solubility improved 宝洁公司 2018-03-09 — — CN disclosed
CN-104769094-A Visually contrasting aesthetic particles having increased water solubility, particularly useful for combination with powdered or granular compositions PROCTER & GAMBLE 2015-07-08 — — CN disclosed
CN-104640966-A Cleaning compositions comprising structured particles PROCTER & GAMBLE 2015-05-20 — — CN disclosed
CN-104603253-A Laundry detergent and cleaning compositions comprising polymers containing carboxyl groups PROCTER & GAMBLE 2015-05-06 — — CN disclosed
CN-104603254-A Laundry detergents and cleaning compositions comprising carboxyl group-containing polymers PROCTER & GAMBLE 2015-05-06 — — CN disclosed
EP-1280882-B2 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS PROCTER & GAMBLE (US) 2014-03-12 — — EP disclosed
CN-102575060-A Thermoplastic polymer composition MILLIKEN & CO 2012-07-11 — — CN disclosed
EP-1228174-A1 AQUEOUS FABRIC SOFTENER COMPOSITIONS CONTAINING HIGHLY UNSATURATED ACTIVE AND SUBSTANTIVE CHELANT THE PROCTER & GAMBLE COMPANY (US) 2002-08-07 — — EP disclosed
WO-2001090285-A1 A FABRIC SOFTENING COMPOSITION COMPRISING A MALODOR CONTROLLING AGENT THE PROCTER & GAMBLE COMPANY (US) 2001-11-29 — — WO disclosed
WO-2001085892-A1 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-11-15 — — WO disclosed
WO-2001034743-A1 AQUEOUS FABRIC SOFTENER COMPOSITIONS CONTAINING HIGHLY UNSATURATED ACTIVE AND CHELANT THE PROCTER & GAMBLE COMPANY (US) 2001-05-17 — — WO disclosed
EP-1068287-A1 CONCENTRATED, STABLE, TRANSLUCENT OR CLEAR, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-01-17 — — EP disclosed
EP-1036147-A1 CLEAR OR TRANSLUCENT AQUEOUS FABRIC SOFTENER COMPOSITIONS CONTAINING HIGH ELECTROLYTE CONTENT AND OPTIONAL PHASE STABILIZER THE PROCTER & GAMBLE COMPANY (US) 2000-09-20 — — EP disclosed
WO-1999045089-A1 CONCENTRATED, STABLE, TRANSLUCENT OR CLEAR, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1999-09-10 — — WO disclosed
WO-1999027050-A1 CLEAR OR TRANSLUCENT AQUEOUS FABRIC SOFTENER COMPOSITIONS CONTAINING HIGH ELECTROLYTE CONTENT AND OPTIONAL PHASE STABILIZER THE PROCTER & GAMBLE COMPANY (US) 1999-06-03 — — WO disclosed
CN-1131969-A Process for preparing concentrated surfactant mixtures containing magnesium PROCTER & GAMBLE (US) 1996-09-25 — — CN disclosed
EP-0408357-A2 Polymerizable composition KURARAY CO., LTD. (JP) 1991-01-16 — — EP disclosed
Send feedback