SCHEMBL26964720

SCHEMBL26964720

COCC(=O)Nc1cc(Cl)ncc1Cl

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 2/20 0.51
HPGD P15428 2/20 0.48
HTT P42858 1/20 0.47
TSHR P16473 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.41
GAA P10253 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
SCHEMBL26964802 0.85 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2LMNAHPGDHTT
SCHEMBL30645650 0.85 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2LMNAHPGDHTT
SCHEMBL21262219 0.79 L3MBTL1 (0.48) ALDH1A1SMN1; SMN2LMNAHPGDHTT
SCHEMBL30456319 0.77 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2HPGDHTTNPC1
SCHEMBL21246720 0.75 KCNQ3 (0.37) SMN1; SMN2NPC1RAB9AKMT2APOLB
SCHEMBL21409463 0.75 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2LMNAHPGDHTT
Acetic Acid SCHEMBL28092089 0.74 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2HPGDHTTNPC1
SCHEMBL21262226 0.74 ATR (0.44)
SCHEMBL23330674 0.73 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2LMNAHPGDHTT
SCHEMBL12748231 0.73 KMT2A (0.71) ALDH1A1SMN1; SMN2LMNAHPGDHTT

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-20240190855-A1 CDK INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2024-06-13 US disclosed
EP-4291176-A1 CDK INHIBITORS AND METHODS OF USE THEREOF Relay Therapeutics, Inc. (US) 2023-12-20 EP disclosed
CN-117136052-A CDK inhibitors and methods of use thereof 传达治疗有限公司 2023-11-28 CN 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-20240190855-A1 CDK INHIBITORS AND METHODS OF USE THEREOF CDK3, CDK8, CDK6 ALDH1A1 3717/4885SMN1; SMN2 1936/4885LMNA 2030/4885

“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.