SCHEMBL309194

SCHEMBL309194

CCC=C(C)c1ccoc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
CYP2C19 P33261 3/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
MAPK1 P28482 1/20 0.39
ESR2 Q92731 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 4/20 0.38
TDP1 Q9NUW8 2/20 0.37
ESR1 P03372 1/20 0.37
NPSR1 Q6W5P4 3/20 0.37
GAA P10253 2/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 2/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL21654305 0.73 HPGD (0.42) TSHRALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL29154573 0.72
SCHEMBL14700052 0.69
SCHEMBL8985724 0.69
SCHEMBL6630555 0.69
SCHEMBL12709976 0.68 TSHR (0.53) TSHRCYP2C19ALDH1A1LMNASMN1; SMN2
SCHEMBL14605008 0.67 CES2 (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1MAPK1
SCHEMBL28474528 0.66 MAPK1 (0.55) TSHRCYP2C19ALDH1A1LMNASMN1; SMN2
SCHEMBL1757222 0.65 ALDH1A1 (0.60) TSHRCYP2C19ALDH1A1LMNASMN1; SMN2
SCHEMBL21780686 0.65 KMT2A (0.30) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2145042-B2 TEXTILE SCENTING HENKEL AG & CO KGAA (DE) 2021-10-06 EP disclosed
EP-2145042-B1 TEXTILE SCENTING HENKEL AG & CO KGAA (DE) 2018-01-17 EP disclosed
EP-2760904-A1 METHOD FOR PRODUCING A MOLDED FOAM ELEMENT Eurofoam GmbH (AT) 2014-08-06 EP disclosed
EP-1981936-B1 FLUID RESERVOIR HENKEL AG & CO KGAA (DE) 2013-04-10 EP disclosed
US-8349781-B2 Fluid reservoir HENKEL AG & CO. KGAA (DE) 2013-01-08 US disclosed
EP-2069468-B1 PERFUME DISPENSING SYSTEM HENKEL AG & CO KGAA (DE) 2012-12-26 EP disclosed
WO-2012135888-A1 METHOD FOR PRODUCING A MOLDED FOAM ELEMENT EUROFOAM GMBH (AT) 2012-10-11 WO disclosed
US-20120093902-A1 FLUID RESERVOIR HENKEL AG & CO. KGAA (DE) 2012-04-19 US disclosed
EP-2097059-B1 CLEANSING OR CARE PRODUCT HENKEL KGAA (DE) 2012-04-18 EP disclosed
US-20120077728-A1 FLUID RESERVOIR HENKEL AG & CO. KGAA (DE) 2012-03-29 US disclosed
WO-2008040620-A1 AROMATIC AGENT DISPENSING SYSTEM HENKEL AG & CO. KGAA (DE) 2008-04-10 WO disclosed
WO-2008012140-A1 LIQUID SUPPORT HENKEL AG & CO. KGAA (DE) 2008-01-31 WO disclosed
WO-2008003631-A1 WASHING, CLEANING AND CARE PRODUCTS HENKEL AG & CO. KGAA (DE) 2008-01-10 WO disclosed
WO-2007131529-A1 TEXTILE TREATMENT AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-11-22 WO disclosed
WO-2007118733-A1 WASHING OR CLEANSING AGENT GRANULATES HENKEL AG & CO. KGAA (DE) 2007-10-25 WO disclosed
WO-2007090451-A1 FLUID RESERVOIR HENKEL AG & CO. KGAA (DE) 2007-08-16 WO disclosed
WO-2007028478-A1 PARTICLES CONTAINING PERFUME HAVING IMPROVED FRAGRANCED PROPERTIES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed
WO-2007028477-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed
WO-2007028480-A1 PARTICLES CONTAINING ZEOLITE AND PERFUME HAVING IMPROVED FRAGRANCE PROPERTIES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed
WO-2007028479-A1 CONSUMER PRODUCTS HAVING VARYING ODORS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120077728-A1 FLUID RESERVOIR CD44, VCL, PEF1 TSHR 3619/4885CYP2C19 4042/4885ALDH1A1 2195/4885
US-20120093902-A1 FLUID RESERVOIR CD44, VCL, PEF1 TSHR 3619/4885CYP2C19 4042/4885ALDH1A1 2195/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.