SCHEMBL20889554

SCHEMBL20889554

Clc1cccc(CNc2c(-c3ccco3)nc3cnccn23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK9 P50750 1/20 0.53
▸ NR1H4 Q96RI1 3/20 0.49
▸ BRAF P15056 2/20 0.49
▸ PLAU P00749 1/20 0.49
▸ SALL4 Q9UJQ4 2/20 0.47
▸ BRD4 O60885 1/20 0.46
▸ PIP4K2A P48426 1/20 0.42
▸ PIK3CG P48736 1/20 0.42
▸ ADORA2A P29274 2/20 0.42
▸ ADORA1 P30542 2/20 0.42
▸ KCNN3 Q9UGI6 1/20 0.42
▸ GALR3 O60755 1/20 0.41
▸ PRNP P04156 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ ATM Q13315 1/20 0.41

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
SCHEMBL20889820 0.87 CDK9 (0.68) CDK9NR1H4BRAFSALL4BRD4
SCHEMBL20889508 0.87 NR1H4 (0.57) NR1H4PLAUMAPTALDH1A1GAA
SCHEMBL20889749 0.85 SALL4 (0.64) CDK9NR1H4BRAFSALL4BRD4
SCHEMBL31193423 0.83 CDK9 (0.76) CDK9NR1H4BRAFPLAUSALL4
SCHEMBL2915672 0.82 BRAF (0.60) BRAFMAPTALDH1A1GAAHPGD
SCHEMBL27075690 0.81 CDK9 (0.56) CDK9NR1H4BRAFPLAUSALL4
SCHEMBL31193286 0.80 CDK9 (0.55) CDK9NR1H4BRAFPLAUSALL4
SCHEMBL20889542 0.79 SALL4 (0.55) CDK9NR1H4PLAUSALL4BRD4
SCHEMBL20889552 0.76 SALL4 (0.81) CDK9PLAUSALL4BRD4MAPT
SCHEMBL20889696 0.75 TRIM33 (0.60) CDK9NR1H4BRAFSALL4BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530209-B2 Small molecule inhibition of transcription factor SALL4 and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-12-20 — — US disclosed
US-20200317664-A1 SMALL MOLECULE INHIBITION OF TRANSCRIPTION FACTOR SALL4 AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-10-08 — — US disclosed
WO-2019070943-A1 SMALL MOLECULE INHIBITION OF TRANSCRIPTION FACTOR SALL4 AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-04-11 — — 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 (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-11530209-B2 Small molecule inhibition of transcription factor SALL4 and uses thereof SALL4, GLI2, TCF4 CDK9 2218/4885NR1H4 1592/4885BRAF 717/4885
US-20200317664-A1 SMALL MOLECULE INHIBITION OF TRANSCRIPTION FACTOR SALL4 AND USES THEREOF SALL4, GLI2, TCF4 CDK9 2218/4885NR1H4 1592/4885BRAF 717/4885

“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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