SCHEMBL16654040

SCHEMBL16654040

CC(C)c1ccnc(NC(=O)c2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.60
RAB9A P51151 5/20 0.60
ATM Q13315 1/20 0.55
ALDH1A1 P00352 1/20 0.52
JAK2 O60674 1/20 0.52
TYK2 P29597 1/20 0.52
BRAF P15056 1/20 0.51
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
MAPKAPK2 P49137 1/20 0.48
CDK2 P24941 2/20 0.48
DEGS1 O15121 1/20 0.48
CCNE1 P24864 1/20 0.48
CDK5 Q00535 1/20 0.48
LMNA P02545 2/20 0.48
CCNA2 P20248 1/20 0.48
CCNA1 P78396 1/20 0.48
GAA P10253 1/20 0.48
HTT P42858 1/20 0.48
MAPK14 Q16539 1/20 0.47

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
SCHEMBL17397127 0.88 RAB9A (0.57) NPC1RAB9AATMALDH1A1JAK2
SCHEMBL23015751 0.86 NPC1 (0.64) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL21349105 0.86 HTR1F (0.54) NPC1RAB9AALDH1A1JAK2DEGS1
SCHEMBL16594482 0.86 CCNA2 (0.56) NPC1RAB9AALDH1A1BRAFKMT2A
SCHEMBL20016542 0.85 MEN1 (0.58) NPC1RAB9AALDH1A1BRAFKMT2A
SCHEMBL2176413 0.80 NPC1 (0.89) NPC1RAB9AATMALDH1A1KMT2A
SCHEMBL17065565 0.80 NPC1 (0.89) NPC1RAB9AATMALDH1A1KMT2A
SCHEMBL24726481 0.80 SIRT2 (0.61) NPC1RAB9AALDH1A1BRAFKMT2A
SCHEMBL7669653 0.80 RAB9A (0.64) NPC1RAB9AATMALDH1A1JAK2
SCHEMBL84076 0.80 L3MBTL1 (0.52) JAK2TYK2BRAFMAPKAPK2MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015057992-A1 BTK INHIBITORS FOR HEMATOPOIETIC MOBILIZATION IZUMI RAQUEL (US) 2015-04-23 WO claimed
US-20240024314-A1 Methods of Treating Splenomegaly TELIOS PHARMA, INC. (US) 2024-01-25 US disclosed
US-11642343-B2 Methods of treating splenomegaly TELIOS PHARMA, INC. (US) 2023-05-09 US disclosed
US-20220387434-A1 COMBINATION OF A BTK INHIBITOR AND AN MDM2 INHIBITOR FOR CANCER TREATMENT QUOGUE IP HOLDINGS LLC (US) 2022-12-08 US disclosed
US-20220184069-A1 METHODS OF TREATING SPLENOMEGALY TELIOS PHARMA, INC. (US) 2022-06-16 US disclosed
WO-2015057992-A1 BTK INHIBITORS FOR HEMATOPOIETIC MOBILIZATION IZUMI RAQUEL (US) 2015-04-23 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 (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-20220387434-A1 COMBINATION OF A BTK INHIBITOR AND AN MDM2 INHIBITOR FOR CANCER TREATMENT BTK, BCL9L, BCL9 NPC1 3690/4885RAB9A 2681/4885ATM 86/4885

“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.