SCHEMBL7202690

SCHEMBL7202690

C=C(C)C(=O)OCCN(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 3/20 0.44
MAOB P27338 2/20 0.43
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HDAC3 O15379 2/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC8 Q9BY41 2/20 0.42
NCOR2 Q9Y618 2/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
SCN1A P35498 1/20 0.42
SCN2A Q99250 1/20 0.42
SCN3A Q9NY46 1/20 0.42
L3MBTL1 Q9Y468 1/20 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
SCHEMBL30751954 0.93 MAOB (0.52) TSHRSMN1; SMN2ALDH1A1MAOBPOLB
SCHEMBL27726006 0.92 TSHR (0.46) TSHRSMN1; SMN2ALDH1A1MAOBLMNA
SCHEMBL24659270 0.91 POLB (0.47) TSHRSMN1; SMN2MAOBPOLBAPEX1
SCHEMBL24659427 0.89 SMN1; SMN2 (0.48) TSHRSMN1; SMN2ALDH1A1MAOBHTT
SCHEMBL23694604 0.88 TDP1 (0.49) TSHRSMN1; SMN2MAOBPOLBAPEX1
SCHEMBL24279649 0.87 SMN1; SMN2 (0.63) TSHRSMN1; SMN2ALDH1A1POLBTDP1
SCHEMBL29910938 0.86 SMN1; SMN2 (0.51) TSHRSMN1; SMN2LMNAL3MBTL1CHRM2
SCHEMBL24727460 0.86 SMN1; SMN2 (0.51) TSHRSMN1; SMN2LMNAL3MBTL1CHRM2
Hydrochloric Acid SCHEMBL28400658 0.85 TSHR (0.43) TSHRSMN1; SMN2ALDH1A1POLBAPEX1
SCHEMBL11314572 0.85 MAOB (0.55) ALDH1A1MAOBCYP2D6SCN1ASCN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11622916-B2 Photocurable composition excellent in curing depth SHOFU INC. (JP) 2023-04-11 US disclosed
CN-115068345-A Dental adhesive composition having excellent storage stability 株式会社松风 2022-09-20 CN disclosed
CN-115068347-A Photocurable composition having excellent depth of cure 株式会社松风 2022-09-20 CN disclosed
CN-115068346-A Dental photocurable composition having excellent handling properties and storage stability 株式会社松风 2022-09-20 CN disclosed
CN-115068348-A Curable composition for dental use having excellent storage stability 株式会社松风 2022-09-20 CN disclosed
US-20220287919-A1 PHOTOCURABLE COMPOSITION EXCELLENT IN CURING DEPTH SHOFU INC. (JP) 2022-09-15 US disclosed
US-20220287918-A1 DENTAL ADHESIVE COMPOSITION EXCELLENT IN STORAGE STABILITY SHOFU INC. (JP) 2022-09-15 US disclosed
CN-113402666-A Dental photocurable composition with excellent color tone selectivity 株式会社松风 2021-09-17 CN disclosed
CN-113402665-A Dental photocurable composition comprising highly soluble photoacid generator 株式会社松风 2021-09-17 CN disclosed
US-6601961-B1 Light guide plate and process for producing the same, surface light source equipment and liquid crystal display DAI NIPPON PRINTING CO., LTD. (JP) 2003-08-05 US disclosed
US-20020181111-A1 Optical sheet KEIWA KABUSHIKI KAISHA, A JAPANESE CORPORATION (JP) 2002-12-05 US 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 (3 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-11622916-B2 Photocurable composition excellent in curing depth ODC1, AOC2, CCNT1 TSHR 4023/4885SMN1; SMN2 2544/4885ALDH1A1 74/4885
US-20220287919-A1 PHOTOCURABLE COMPOSITION EXCELLENT IN CURING DEPTH ODC1, AOC2, CCNT1 TSHR 4012/4885SMN1; SMN2 2542/4885ALDH1A1 74/4885
US-20220287918-A1 DENTAL ADHESIVE COMPOSITION EXCELLENT IN STORAGE STABILITY ITGA1, ITGB1, CDH1 TSHR 3917/4885SMN1; SMN2 1094/4885ALDH1A1 20/4885

“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.