SCHEMBL21045385

SCHEMBL21045385

Cc1ncc(C(=O)NCCCc2ccc(-c3cnc4[nH]ncc4c3)cc2)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.41
USP2 O75604 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CNR1 P21554 1/20 0.40
PIK3C3 Q8NEB9 2/20 0.39
CLK2 P49760 2/20 0.39
DYRK1A Q13627 2/20 0.39
PLK4 O00444 1/20 0.39
AURKA O14965 1/20 0.39
PRKD3 O94806 1/20 0.39
MAP4K4 O95819 1/20 0.39
CHEK2 O96017 1/20 0.39
ROS1 P08922 1/20 0.39
RPS6KB1 P23443 1/20 0.39
MAPK1 P28482 1/20 0.39
FLT4 P35916 1/20 0.39
GSK3A P49840 1/20 0.39
IRAK1 P51617 1/20 0.39

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
SCHEMBL21045219 0.89 ROCK2 (0.48) NPC1USP2RAB9ASMN1; SMN2L3MBTL1
SCHEMBL29411359 0.89 ROCK2 (0.48) NPC1USP2RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21045204 0.88 RXRA (0.40) NPC1USP2RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21045252 0.87 FLT3 (0.52) FLT3
SCHEMBL29411516 0.82 HDAC1 (0.41) NPC1USP2RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21045460 0.82 HDAC1 (0.41) NPC1USP2RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21045260 0.81 KDM4E (0.52) NAMPTGSK3BPTAFR
SCHEMBL21045301 0.80 POLB (0.39) NPC1USP2RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21045388 0.79 DYRK1A (0.40) NPC1USP2RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21045189 0.79 PIK3C3 (0.40) L3MBTL1CNR1PIK3C3NAMPTFLT3

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
US-20250188035-A1 TUBULIN INHIBITORS LIN BIOSCIENCE LLC (US) 2025-06-12 US disclosed
US-12247010-B2 Tubulin inhibitors LIN BIOSCIENCE INC. (TW) 2025-03-11 US disclosed
US-20220089539-A1 TUBULIN INHIBITORS LIN BIOSCIENCE INC. (TW) 2022-03-24 US disclosed
US-20220089539-A1 TUBULIN INHIBITORS LIN BIOSCIENCE INC. (TW) 2022-03-24 US disclosed
US-11040945-B2 Tubulin inhibitors LIN BIOSCIENCE PTY LTD. 2021-06-22 US disclosed
US-11040945-B2 Tubulin inhibitors LIN BIOSCIENCE PTY LTD. 2021-06-22 US disclosed
WO-2019113242-A1 TUBULIN INHIBITORS Lin BioScience, LLC (US) 2019-06-13 WO disclosed
US-20190169127-A1 TUBULIN INHIBITORS LIN BIOSCIENCE INC. (TW) 2019-06-06 US disclosed
US-20190169127-A1 TUBULIN INHIBITORS LIN BIOSCIENCE INC. (TW) 2019-06-06 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 (5 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-20220089539-A1 TUBULIN INHIBITORS TUBB3, TUBB1, TUBB NPC1 421/4885USP2 3072/4885RAB9A 959/4885
US-12247010-B2 Tubulin inhibitors TUBB3, TUBB1, TUBB NPC1 421/4885USP2 3072/4885RAB9A 959/4885
US-11040945-B2 Tubulin inhibitors TUBB3, TUBB1, TUBB NPC1 421/4885USP2 3072/4885RAB9A 959/4885
US-20250188035-A1 TUBULIN INHIBITORS TUBB3, TUBB1, TUBB NPC1 421/4885USP2 3072/4885RAB9A 959/4885
US-20190169127-A1 TUBULIN INHIBITORS TUBB3, TUBB1, TUBB NPC1 421/4885USP2 3072/4885RAB9A 959/4885

“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.