SCHEMBL5637633

SCHEMBL5637633

O=C(Nc1[nH]n(-c2c(Cl)cc(Cl)cc2Cl)c(=O)c1Br)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MEN1 O00255 1/20 0.39
PABPC1 P11940 1/20 0.39
CCR6 P51684 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
KCNK3 O14649 2/20 0.39
KCNK9 Q9NPC2 2/20 0.39
KCNMA1 Q12791 1/20 0.39
MAPT P10636 2/20 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
SCHEMBL5636397 0.79 MAPT (0.39) NPC1RAB9ACA12CA9KDM4E
SCHEMBL4591297 0.78 NPC1 (0.44) NPC1RAB9ACA12CA9HDAC1
SCHEMBL9727104 0.66 P2RX1 (0.50) NPC1RAB9ARXFP1MEN1KMT2A
SCHEMBL10396769 0.66 SMN1; SMN2 (0.51) HDAC1KDM4ENPSR1MEN1KMT2A
SCHEMBL11685836 0.66 MEN1 (0.41) NPC1RAB9ACA12CA9HDAC1
SCHEMBL10875014 0.65 MEN1 (0.68) NPC1RAB9AMEN1KMT2AKCNK3
SCHEMBL6667710 0.64 RAB9A (0.74) NPC1RAB9ANPSR1MEN1KMT2A
SCHEMBL3790097 0.64 RAB9A (0.74) NPC1RAB9ANPSR1MEN1KMT2A
SCHEMBL8804658 0.63 KDM4E (0.82) NPC1RAB9AKDM4ENPSR1RXFP1
SCHEMBL13741419 0.62 MEN1 (0.45) NPC1RAB9ANPSR1MEN1KMT2A

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-7176321-B2 Method for producing 3-amino-4-substituted-5-pyrazolones FUJI PHOTO FILM CO., LTD. (JP) 2007-02-13 US disclosed
US-20040204589-A1 Method for producing 3-amino-4-substituted-5-pyrazolones FUJIFILM CORPORATION (JP) 2004-10-14 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 (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-20040204589-A1 Method for producing 3-amino-4-substituted-5-pyrazolones KCNH3, KCNH2, KCNJ11 NPC1 3067/4885RAB9A 585/4885CA12 1458/4885

“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.