SCHEMBL8098121

SCHEMBL8098121

COc1ccc(CCNC(=O)C2CCCC2)cc1OC

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.71
MEN1 O00255 3/20 0.71
ALDH1A1 P00352 6/20 0.71
TSHR P16473 2/20 0.71
KDM4E B2RXH2 1/20 0.71
MAPT P10636 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.69
HTT P42858 1/20 0.69
EPHX1 P07099 1/20 0.68
GAA P10253 1/20 0.66
PTBP1 P26599 1/20 0.64

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
SCHEMBL11735352 0.99 ALDH1A1 (0.72) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL8747121 0.97 KMT2A (0.71) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL7838949 0.95 KMT2A (0.74) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL7279469 0.89 ALDH1A1 (0.71) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL7279475 0.89 ALDH1A1 (0.71) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL7417537 0.87 KMT2A (0.59) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL8928239 0.87 KMT2A (0.65) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL3351763 0.86 KMT2A (0.60) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL8549452 0.84 KMT2A (0.61) KMT2AMEN1ALDH1A1TSHRKDM4E
SCHEMBL21540592 0.83 KDM4E (0.76) KMT2AMEN1ALDH1A1TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11872236-B2 Pharmacological agents for treating ocular diseases CALASIA PHARMACEUTICALS, INC. (US) 2024-01-16 US disclosed
US-11872236-B2 Pharmacological agents for treating ocular diseases CALASIA PHARMACEUTICALS, INC. (US) 2024-01-16 US disclosed
CN-112601513-B Medicine for treating eye diseases 普莱克斯医药公司 2023-12-22 CN disclosed
US-20210154213-A1 PHARMACOLOGICAL AGENTS FOR TREATING OCULAR DISEASES CALASIA PHARMACEUTICALS INC (US) 2021-05-27 US disclosed
US-20210154213-A1 PHARMACOLOGICAL AGENTS FOR TREATING OCULAR DISEASES CALASIA PHARMACEUTICALS INC (US) 2021-05-27 US disclosed
CN-112601513-A Medicine for treating eye diseases 普莱克斯医药公司 2021-04-02 CN disclosed
EP-0792883-B1 Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-12-20 EP disclosed
EP-0792883-A1 Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1997-09-03 EP 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-20210154213-A1 PHARMACOLOGICAL AGENTS FOR TREATING OCULAR DISEASES CRYAA, CRYAB, TTR KMT2A 4785/4885MEN1 3695/4885ALDH1A1 1822/4885
US-11872236-B2 Pharmacological agents for treating ocular diseases CRYAA, CRYAB, TTR KMT2A 4785/4885MEN1 3695/4885ALDH1A1 1822/4885

“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.