SCHEMBL5004409

SCHEMBL5004409

O=S(=O)(O)c1cccc2c(O)nccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.53
COMT P21964 1/20 0.50
MEN1 O00255 1/20 0.49
NSD2 O96028 1/20 0.49
POLB P06746 1/20 0.49
IDE P14735 1/20 0.49
DUSP3 P51452 1/20 0.49
CCR6 P51684 1/20 0.49
BLM P54132 1/20 0.49
KMT2A Q03164 1/20 0.49
CYP1A2 P05177 4/20 0.45
HIF1A Q16665 2/20 0.44
ALDH1A1 P00352 1/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
AURKA O14965 1/20 0.42
AURKB Q96GD4 1/20 0.42
CDK2 P24941 1/20 0.42
HPGD P15428 1/20 0.40
CTRB1 P17538 1/20 0.38

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
SCHEMBL21903885 0.84 CDK2 (0.41) TTRCOMTMEN1NSD2POLB
SCHEMBL7735396 0.84 CDK2 (0.62) TTRCOMTMEN1NSD2POLB
SCHEMBL5007156 0.81 TTR (0.51) TTRCOMTMEN1NSD2POLB
SCHEMBL30233642 0.80 TTR (0.75) TTRCOMTMEN1NSD2POLB
SCHEMBL6242 0.80 TTR (0.75) TTRCOMTMEN1NSD2POLB
SCHEMBL29363198 0.80 TTR (0.75) TTRCOMTMEN1NSD2POLB
Hydrochloric Acid SCHEMBL10824889 0.79 TTR (0.50) TTRCOMTMEN1NSD2POLB
Ammonia Solution, Strong SCHEMBL25312340 0.78 TTR (0.72) TTRCOMTMEN1NSD2POLB
Ammonia Solution, Strong SCHEMBL10954121 0.78 TTR (0.72) TTRCOMTMEN1NSD2POLB
Water SCHEMBL242080 0.78 TTR (0.72) TTRCOMTMEN1NSD2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113227054-B ROCK kinase inhibitors 切尔韦洛治疗有限责任公司 2025-04-11 CN disclosed
EP-3877364-B1 ROCK KINASE INHIBITORS Cervello Therapeutics LLC (US) 2024-08-21 EP disclosed
US-11912719-B2 Substituted isoquinolines as rock kinase inhibitors CERVELLO THERAPEUTICS, LLC. (US) 2024-02-27 US disclosed
CN-115951558-A Photosensitive resin composition containing polysiloxane 上海玟昕科技有限公司 2023-04-11 CN disclosed
US-20220119406-A1 SUBSTITUTED ISOQUINOLINES AS ROCK KINASE INHIBITORS Cervello Therapeutics LLC (US) 2022-04-21 US disclosed
US-11248004-B2 Substituted isoquinolines as rock kinase inhibitors CERVELLO THERAPEUTICS, LLC. (US) 2022-02-15 US disclosed
EP-3877364-A1 ROCK KINASE INHIBITORS Cervello Therapeutics, LLC (US) 2021-09-15 EP disclosed
CN-113227054-A ROCK kinase inhibitors 切尔韦洛治疗有限责任公司 2021-08-06 CN disclosed
US-20200262844-A1 ROCK KINASE INHIBITORS CERVELLO THERAPEUTICS, LLC. 2020-08-20 US disclosed
US-10745381-B2 Substituted isoquinolines and phthalazines as rock kinase inhibitors CERVELLO THERAPEUTICS, LLC. (US) 2020-08-18 US disclosed
US-20200140412-A1 ROCK KINASE INHIBITORS CERVELLO THERAPEUTICS, LLC. 2020-05-07 US disclosed
US-7414063-B2 Inhibitors of Akt (protein kinase B) ELI LILLY AND COMPANY (US) 2008-08-19 US disclosed
US-20070043040-A1 Inhibitors of akt (protein kinase b) ELI LILLY AND COMPANY 2007-02-22 US disclosed
CN-1768040-A Isoquinoline-5-sulfonic acid amides as inhibitors of AKT (protein kinase B) LILLY CO ELI (US) 2006-05-03 CN disclosed
EP-1611105-A1 ISOQUINOLINE-5-SULFONIC ACID AMIDES AS INHIBITORS OF AKT (PROTEIN KINASE B) ELI LILLY AND COMPANY (US) 2006-01-04 EP disclosed
WO-2004094386-A1 ISOQUINOLINE-5-SULFONIC ACID AMIDES AS INHIBITORS OF AKT (PROTEIN KINASE B) ELI LILLY AND COMPANY (US) 2004-11-04 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 (7 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-10745381-B2 Substituted isoquinolines and phthalazines as rock kinase inhibitors ROCK1, ROCK2, CIT TTR 4852/4885COMT 1802/4885MEN1 467/4885
US-11248004-B2 Substituted isoquinolines as rock kinase inhibitors ROCK1, ROCK2, CIT TTR 4855/4885COMT 1290/4885MEN1 455/4885
US-20070043040-A1 Inhibitors of akt (protein kinase b) AKT1, AKT2, BRAF TTR 4493/4885COMT 4168/4885MEN1 1215/4885
US-11912719-B2 Substituted isoquinolines as rock kinase inhibitors ROCK1, ROCK2, CIT TTR 4855/4885COMT 1290/4885MEN1 455/4885
US-20200140412-A1 ROCK KINASE INHIBITORS ROCK1, ROCK2, RHOA TTR 4857/4885COMT 2191/4885MEN1 239/4885
US-20200262844-A1 ROCK KINASE INHIBITORS ROCK1, ROCK2, RHOA TTR 4857/4885COMT 2191/4885MEN1 239/4885
US-20220119406-A1 SUBSTITUTED ISOQUINOLINES AS ROCK KINASE INHIBITORS ROCK1, ROCK2, CIT TTR 4855/4885COMT 1290/4885MEN1 455/4885

“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.