SCHEMBL18320105

SCHEMBL18320105

O=C(Cl)NCc1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
PLA2G1B P04054 2/20 0.59
ATG4B Q9Y4P1 2/20 0.59
HTT P42858 1/20 0.58
HPGD P15428 3/20 0.56
RAB9A P51151 3/20 0.56
ALDH1A1 P00352 1/20 0.56
POLB P06746 2/20 0.56
KMT2A Q03164 2/20 0.54
TP53 P04637 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
NPC1 O15118 1/20 0.54
MAOB P27338 1/20 0.54
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53

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
SCHEMBL18415459 0.83 LMNA (0.66) LMNAPLA2G1BATG4BHTTHPGD
SCHEMBL6468546 0.83 RAB9A (0.68) LMNAPLA2G1BATG4BHTTHPGD
SCHEMBL31294636 0.81 MEN1 (0.73) HPGDRAB9AALDH1A1POLBKMT2A
SCHEMBL2553685 0.81 HTT (0.65) LMNAPLA2G1BATG4BHTTHPGD
SCHEMBL1274911 0.80 LMNA (0.68) LMNAPLA2G1BATG4BHTTHPGD
SCHEMBL2530016 0.79 KMT2A (0.63) LMNAPLA2G1BATG4BHTTHPGD
SCHEMBL689542 0.79 CYP2C19 (0.66) LMNAPLA2G1BATG4BHTTHPGD
SCHEMBL5318410 0.79 LMNA (0.61) LMNAPLA2G1BATG4BHTTHPGD
SCHEMBL4963071 0.79 LMNA (0.56) LMNAPLA2G1BATG4BHTTHPGD
SCHEMBL1423344 0.78 GAA (0.59) LMNAHPGDALDH1A1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3310775-B1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES Bayer Pharma AG (DE) 2020-04-01 EP disclosed
US-10227299-B2 3-amino-1,5,6,7-tetrahydro-4H-indol-4-ones BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-03-12 US disclosed
US-20180155285-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-06-07 US disclosed
EP-3310775-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-04-25 EP disclosed
WO-2016202755-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-22 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 (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-10227299-B2 3-amino-1,5,6,7-tetrahydro-4H-indol-4-ones MYC, HCCS, MCL1 LMNA 3607/4885PLA2G1B 3341/4885ATG4B 187/4885
US-20180155285-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES HCCS, MCL1, MKI67 LMNA 3608/4885PLA2G1B 3012/4885ATG4B 106/4885

“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.