Sugi Predict

Sugi Predict / Compounds / SCHEMBL216499

SCHEMBL216499

SCHEMBL216499

Cc1ccccc1Sc1ccc(C=O)c(-c2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.40
▸ TSHR P16473 1/20 0.40
▸ AR P10275 2/20 0.39
▸ FFAR1 O14842 1/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ HTR2C P28335 1/20 0.34
▸ HTR6 P50406 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ CYP2A6 P11509 1/20 0.33
▸ CYP2B6 P20813 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ PSMB5 P28074 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ ADORA3 P0DMS8 1/20 0.32
▸ ADORA2A P29274 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
SCHEMBL181632 0.82 ALDH1A1 (0.46) ALDH1A1TSHRARFFAR1KDM4E
SCHEMBL6716919 0.82 AR (0.44) ALDH1A1TSHRARFFAR1NPC1
SCHEMBL28195991 0.73 PSMB5 (0.50) ALDH1A1TSHRNPC1RAB9AKDM4E
SCHEMBL15418919 0.72 AR (0.43) ALDH1A1TSHRARFFAR1KDM4E
SCHEMBL17521454 0.72 ALDH1A1 (0.48) ALDH1A1TSHRARFFAR1L3MBTL1
SCHEMBL17508156 0.71 ALDH1A1 (0.59) ALDH1A1TSHRARTDP1HPGD
Ethane SCHEMBL28136904 0.71 AR (0.42) ALDH1A1ARFFAR1KDM4EHTR2C
SCHEMBL29818705 0.70 ALDH1A1 (0.47) ALDH1A1TSHRNPC1RAB9AKDM4E
SCHEMBL29818666 0.70 ALDH1A1 (0.47) ALDH1A1TSHRNPC1RAB9AKDM4E
SCHEMBL99595 0.70 CA12 (0.44) ALDH1A1TSHRARFFAR1KDM4E

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
US-11512204-B2 Squarylium dye and composition containing same TOYO INK SC HOLDINGS CO., LTD. (JP) 2022-11-29 — — US disclosed
CN-108474885-B Near-infrared absorbing composition for solid-state imaging element, filter, and solid-state imaging element 东洋油墨SC控股株式会社 2021-04-13 — — CN disclosed
US-20200115556-A1 SQUARYLIUM DYE AND COMPOSITION CONTAINING SAME TOYO INK SC HOLDINGS CO., LTD. (JP) 2020-04-16 — — US disclosed
US-8088836-B2 Oxime ester compounds and photosensitive resin compositions using the same NIPPON CHEMICAL WORKS CO., LTD. (JP) 2012-01-03 — — US disclosed
US-20100210749-A1 Oxime ester compounds and photosensitive resin compositions using the same NIPPON CHEMICAL WORKS CO., LTD. 2010-08-19 — — US disclosed
US-20090226822-A1 RECORDING MEDIUM KABUSHIKI KAISHA TOSHIBA 2009-09-10 — — 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 (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-20100210749-A1 Oxime ester compounds and photosensitive resin compositions using the same PPOX, FTO, NR2E3 ALDH1A1 656/4885TSHR 3863/4885AR 3186/4885

“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.