SCHEMBL24516633

SCHEMBL24516633

Cc1ccc(-c2cccc(NC(=S)NC(=O)O)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
KDM4E B2RXH2 1/20 0.46
ADORA3 P0DMS8 4/20 0.45
MAPT P10636 4/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
CNR1 P21554 1/20 0.44
KDR P35968 1/20 0.43
EPHB4 P54760 1/20 0.43
TEK Q02763 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
GBA1 P04062 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL22523898 0.85 NPC1 (0.45) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL2772033 0.80 KMT2A (0.44) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL2771385 0.80 MEN1 (0.46) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL4327363 0.79 KMT2A (0.74) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL2773703 0.76 MEN1 (0.56) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL2251549 0.75 SCN9A (0.49)
SCHEMBL3028344 0.75 GRM5 (0.50) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL2771743 0.75 RAB9A (0.49) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL21021758 0.74 ADORA3 (0.44) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL22728512 0.73 GRM5 (0.64) NPC1RAB9AMEN1KMT2AADORA3

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-20220185810-A1 Novel Process for the Preparation of Filgotinib and Intermediates Thereof UNICHEM LABORATORIES LIMITED (IN) 2022-06-16 US disclosed
CN-110204542-B Synthetic method of JAK1 inhibitor Filgotinib 四川伊诺达博医药科技有限公司 2022-05-20 CN 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-20220185810-A1 Novel Process for the Preparation of Filgotinib and Intermediates Thereof ABL1, JAK1, JAK3 NPC1 2673/4885RAB9A 471/4885MEN1 1105/4885

“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.