SCHEMBL29890100

SCHEMBL29890100

Brc1ccc(Br)c2cnccc12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.72
IMPDH2 P12268 2/20 0.42
EP300 Q09472 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT8 Q9H7Z6 1/20 0.39
CHUK O15111 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
ADORA3 P0DMS8 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
SLC22A12 Q96S37 1/20 0.36
PIM1 P11309 2/20 0.36
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36
HASPIN Q8TF76 1/20 0.36
KDM4E B2RXH2 2/20 0.35
PRKCI P41743 2/20 0.35
ACHE P22303 1/20 0.35

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
SCHEMBL244397 1.00 AXL (0.72) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL17558948 0.84 AXL (0.55) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL22787692 0.84 AXL (0.55) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL3362445 0.84 EP300 (0.60) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL12245721 0.84 AXL (0.60) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL24724775 0.84 AXL (0.55) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL12957492 0.84 AXL (0.55) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL21917158 0.84 AXL (0.60) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL4021511 0.84 AXL (0.85) AXLIMPDH2EP300KAT2BKAT8
SCHEMBL246823 0.84 AXL (1.00) AXLIMPDH2EP300KAT2BKAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115161016-B Sensor for detecting kaempferol and quercetin in tobacco leaves and preparation method thereof 云南省烟草质量监督检测站 2024-04-30 CN claimed
US-12606533-B2 3-phenylpropylamine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2026-04-21 US disclosed
US-20250353824-A1 3-PHENYLPROPYLAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-11-20 US disclosed
CN-112996786-B Compounds for inhibiting alpha 4 beta 7 integrin 吉利德科学公司 2024-08-20 CN disclosed
CN-115161016-B Sensor for detecting kaempferol and quercetin in tobacco leaves and preparation method thereof 云南省烟草质量监督检测站 2024-04-30 CN disclosed
CN-112969504-B Compounds for inhibiting alpha 4 beta 7 integrin 吉利德科学公司 2024-04-09 CN disclosed
EP-4313951-A1 1,3-SUBSTITUTED CYCLOBUTYL DERIVATIVES AND USES THEREOF Novartis AG (CH) 2024-02-07 EP disclosed
CN-117062804-A 1, 3-substituted cyclobutyl derivatives and their use 诺华股份有限公司 2023-11-14 CN disclosed
WO-2022201097-A1 1,3-SUBSTITUTED CYCLOBUTYL DERIVATIVES AND USES THEREOF NOVARTIS AG (CH) 2022-09-29 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-20250353824-A1 3-PHENYLPROPYLAMINE DERIVATIVE SF1, SF3A1, SFXN1 AXL 834/4885IMPDH2 2299/4885EP300 1488/4885
US-12606533-B2 3-phenylpropylamine derivative SF3A1, SF1, HTR1D AXL 1130/4885IMPDH2 2486/4885EP300 2218/4885

“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.