SCHEMBL30127342

SCHEMBL30127342

CC(=O)Nc1ncc(Cl)cc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.49
PIK3CA P42336 2/20 0.44
MTOR P42345 1/20 0.44
DHODH Q02127 1/20 0.41
EGFR P00533 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
ABL1 P00519 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KCNQ3 O43525 1/20 0.38
KCNQ2 O43526 1/20 0.38
KCNQ5 Q9NR82 1/20 0.38
LMNA P02545 1/20 0.38
NPC1 O15118 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
IRAK4 Q9NWZ3 1/20 0.37

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
SCHEMBL12515442 1.00 PTK2 (0.49) PTK2PIK3CAMTORDHODHEGFR
SCHEMBL11446331 0.82 PTK2 (0.51) PTK2L3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL12515205 0.82 L3MBTL1 (0.41) PTK2L3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL21138716 0.81 GPR35 (0.42) PIK3CAMTORDHODHL3MBTL1KMT2A
SCHEMBL9995068 0.79 PTK2 (0.49) PTK2PIK3CAMTORL3MBTL1ALDH1A1
SCHEMBL7604051 0.79 S1PR1 (0.44) L3MBTL1ALDH1A1KMT2AMAPTRAB9A
SCHEMBL21847399 0.76 APP (0.39) PIK3CADHODHKMT2AMEN1IRAK4
SCHEMBL30496376 0.76 IRAK4 (0.47) L3MBTL1IRAK4
Hydrochloric Acid SCHEMBL28482242 0.74 APP (0.38) PIK3CADHODHKMT2AMEN1IRAK4
SCHEMBL21865452 0.73 FFAR2 (0.41) DHODHL3MBTL1ALDH1A1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357162-A1 COMPOUNDS, COMPOSITIONS AND METHODS TENVIE THERAPEUTICS, INC. 2023-11-09 US disclosed
WO-2022266458-A1 6-HETEROCYCLOALKYL-QUINAZOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 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-20230357162-A1 COMPOUNDS, COMPOSITIONS AND METHODS NLRP3, NLRP1, NOD1 PTK2 4749/4885PIK3CA 1685/4885MTOR 1168/4885

“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.