SCHEMBL20110258

SCHEMBL20110258

Cc1nc(Br)nn1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
FCGR1A P12314 1/20 0.42
KDM4E B2RXH2 3/20 0.40
HPGD P15428 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
GAA P10253 2/20 0.39
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
GRM1 Q13255 1/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL18136489 0.79 SMN1; SMN2 (0.46) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL19668789 0.79 KMT2A (0.42) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL236974 0.76 KDM4A (0.45) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL11510201 0.76 MAPK1 (0.43) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL11582679 0.76 SMN1; SMN2 (0.52) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL244872 0.76 LMNA (0.44) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL14007393 0.74 NPC1 (0.52) SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL24610231 0.73 FCGR1A (0.43) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL21849228 0.73 GRN (0.45) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1
SCHEMBL21217389 0.73 ALDH1A1 (0.46) MAPK1SMN1; SMN2CYP1A2CYP2C19NPC1

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
EP-4584259-A1 CK1ALPHA AND DUAL CK1ALPHA / GSPT1 DEGRADING COMPOUNDS Innovo Therapeutics, Inc. (US) 2025-07-16 EP disclosed
US-20240158370-A1 CK1 alpha AND DUAL CK1 alpha / GSPT1 DEGRADING COMPOUNDS INNOVO THERAPEUTICS, INC. 2024-05-16 US disclosed
WO-2024054832-A1 CK1α AND DUAL CK1α / GSPT1 DEGRADING COMPOUNDS INNOVO THERAPEUTICS, INC. (US) 2024-03-14 WO disclosed
US-20180118697-A1 TRIAZOLE BENZAMIDE DERIVATIVES AND THE COMPOSITIONS AND METHODS OF TREATMENT REGARDING THE SAME NYSNOBIO IRELAND DAC (IE) 2018-05-03 US 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-20240158370-A1 CK1 alpha AND DUAL CK1 alpha / GSPT1 DEGRADING COMPOUNDS CKS1B, CKS2, MARK1 MAPK1 592/4885SMN1; SMN2 2663/4885CYP1A2 3467/4885
US-20180118697-A1 TRIAZOLE BENZAMIDE DERIVATIVES AND THE COMPOSITIONS AND METHODS OF TREATMENT REGARDING THE SAME PINK1, ATG7, ADRM1 MAPK1 2124/4885SMN1; SMN2 1999/4885CYP1A2 376/4885

“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.