SCHEMBL14640959

SCHEMBL14640959

CSc1c(C(C)(C)C)cc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
POLB P06746 2/20 0.36
ALDH1A1 P00352 4/20 0.35
ALOX15 P16050 3/20 0.35
MAPT P10636 3/20 0.35
CYP1A2 P05177 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ATP2A2 P16615 1/20 0.35
ATP2A3 Q93084 1/20 0.35
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HSP90AA1 P07900 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
HPN P05981 1/20 0.32

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
SCHEMBL24344713 0.89 POLB (0.41) GABRA1GABRB2POLBALDH1A1ALOX15
SCHEMBL18802806 0.84 GABRA1 (0.39) GABRA1GABRB2POLBALDH1A1ALOX15
SCHEMBL21950842 0.83 HIF1A (0.34) GABRA1GABRB2ALDH1A1ALOX15CYP1A2
SCHEMBL3178010 0.82 GABRA1 (0.40) GABRA1GABRB2POLBALDH1A1ALOX15
SCHEMBL21950844 0.80 GABRA1 (0.33) GABRA1GABRB2
SCHEMBL2631798 0.80 SMN1; SMN2 (0.52) POLBALDH1A1ALOX15MAPTCYP1A2
SCHEMBL26551956 0.79 NR5A2 (0.33) ALDH1A1CYP1A2CYP3A4CYP2C9TSHR
SCHEMBL3177948 0.76 GABRA1 (0.36) GABRA1GABRB2POLBALDH1A1ALOX15
SCHEMBL11357994 0.76 POLB (0.46) GABRA1GABRB2POLBALDH1A1ALOX15
SCHEMBL3176272 0.75 GABRA1 (0.34) GABRA1GABRB2POLBALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4270108-A1 CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION AND RESIST PATTERN FORMING PROCESS Shin-Etsu Chemical Co., Ltd. (JP) 2023-11-01 EP disclosed
EP-4258056-A2 ALCOHOL COMPOUND, CHEMICALLY AMPLIFIED NEGATIVE RESIST COMPOSITION AND RESIST PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-10-11 EP disclosed
EP-4047418-B1 CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION AND RESIST PATTERN FORMING PROCESS SHINETSU CHEMICAL CO (JP) 2023-08-16 EP disclosed
US-20220085302-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-03-17 US disclosed
WO-2007005676-A2 ACTIVATOR COMPOSITIONS AND THEIR USE IN CATALYSTS AND OLEFIN POLYMERIZATION ALBEMARLE CORPORATION (US) 2007-01-11 WO disclosed
WO-2007005921-A2 BRONSTED ACIDIC ALUMINOXANE COMPOSITIONS AND THEIR USE IN OLEFIN POLYMERIZATION CATALYST COMPOSITIONS ALBEMARLE CORPORATION (US) 2007-01-11 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 (1 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-20220085302-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LIFR, LBR, EPOR GABRA1 460/4885GABRB2 580/4885POLB 2638/4885

“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.