P-Cymene

P-Cymene

SCHEMBL6454352

C=CC.Cc1ccc(C(C)C)cc1.Cc1ccccc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.46
▸ ACHE P22303 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ CNR2 P34972 3/20 0.43
▸ TYR P14679 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ BCHE P06276 1/20 0.37
▸ ANXA2 P07355 1/20 0.36
▸ S100A10 P60903 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ EGFR P00533 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ CHRNA7 P36544 1/20 0.35
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 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
P-Cymene SCHEMBL10727873 1.00 LMNA (0.46) LMNAACHETSHRALOX12CNR2
P-Cymene SCHEMBL10723652 0.96 CNR2 (0.41) LMNAACHETSHRALOX12CNR2
P-Cymene SCHEMBL11358150 0.91 TYR (0.44) LMNAACHECNR2TYRBCHE
P-Cymene SCHEMBL10723645 0.89 ACP3 (0.41) LMNAACHETSHRALOX12CNR2
P-Cymene SCHEMBL8208471 0.89 ACHE (0.58) LMNAACHETSHRALOX12CNR2
P-Cymene SCHEMBL10942903 0.89 ACHE (0.58) LMNAACHETSHRALOX12CNR2
Toluene SCHEMBL29188898 0.87 LMNA (0.61) LMNAACHETSHRALOX12CNR2
Isopropylbenzene SCHEMBL7158490 0.84 TAAR1 (0.41) LMNATSHRTYRKDM4EMAPK1
P-Cymene SCHEMBL1292746 0.84 ACHE (0.50) LMNAACHETSHRALOX12CNR2
Isopropylbenzene SCHEMBL3122914 0.84 TAAR1 (0.41) LMNATSHRTYRKDM4EMAPK1

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-1558550-A1 AROMATICS CONVERSION WITH ITQ-13 ExxonMobil Chemical Patents Inc. (US) 2005-08-03 — — EP disclosed
WO-2004041756-A1 AROMATICS CONVERSION WITH ITQ-13 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-05-21 — — WO disclosed
US-4375573-A DISPROPORTIONATION AND ALKYLATION MOBIL OIL CORPORATION (US) 1983-03-01 — — US disclosed
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