SCHEMBL22721404

SCHEMBL22721404

CC[C@@H](O)CNCc1cnc2ccccc2c1Cl

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 1/20 0.47
▸ DNM1 Q05193 11/20 0.41
▸ MITF O75030 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ TLR7 Q9NYK1 1/20 0.35
▸ CD274 Q9NZQ7 3/20 0.35
▸ PDCD1LG2 Q9BQ51 1/20 0.35
▸ PDCD1 Q15116 1/20 0.33

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
SCHEMBL22721406 1.00 ROCK2 (0.47) ROCK2DNM1MITFALDH1A1LMNA
SCHEMBL22721410 0.85 ROCK2 (0.47) ROCK2DNM1MITFALDH1A1LMNA
SCHEMBL22721408 0.85 ROCK2 (0.47) ROCK2DNM1MITFALDH1A1LMNA
SCHEMBL22743865 0.77 CD274 (0.47) MITFALDH1A1LMNASMN1; SMN2NPSR1
SCHEMBL18322510 0.74 ROCK2 (0.46) ROCK2DNM1ALDH1A1NPSR1CD274
SCHEMBL20297332 0.74 ROCK2 (0.46) ROCK2DNM1ALDH1A1NPSR1CD274
SCHEMBL26324062 0.74 MAOA (0.45) —
SCHEMBL22721455 0.73 KMT2A (0.50) ROCK2DNM1ALDH1A1SMN1; SMN2CD274
SCHEMBL22721453 0.73 KMT2A (0.50) ROCK2DNM1ALDH1A1SMN1; SMN2CD274
SCHEMBL844114 0.72 MAOA (0.47) ALDH1A1TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114174289-B Benzotriazole derivatives UBE株式会社 2025-03-07 — — CN disclosed
US-20220259223-A1 BENZOTRIAZOLE DERIVATIVE UBE INDUSTRIES, LTD. (JP) 2022-08-18 — — US disclosed
CN-114174289-A Benzotriazole derivatives 宇部兴产株式会社 2022-03-11 — — CN disclosed
WO-2020241853-A1 BENZOTRIAZOLE DERIVATIVE 宇部興産株式会社 2020-12-03 — — 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-20220259223-A1 BENZOTRIAZOLE DERIVATIVE KEAP1, NFE2L2, BACH1 ROCK2 3375/4885DNM1 3319/4885MITF 33/4885

“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.

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