SCHEMBL19176830

SCHEMBL19176830

CCC(C)c1nn(C)c2c1CCCC2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.33
LMNA P02545 4/20 0.33
HTT P42858 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
BRD4 O60885 1/20 0.33
POLB P06746 2/20 0.33
CYP1A2 P05177 1/20 0.33
GAA P10253 1/20 0.33
GRM5 P41594 1/20 0.32
PABPC1 P11940 1/20 0.31
APOBEC3A P31941 1/20 0.31
ATM Q13315 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
SSTR4 P31391 1/20 0.31
NPC1 O15118 3/20 0.30
SLC2A1 P11166 3/20 0.30
PAX8 Q06710 2/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
NPSR1 Q6W5P4 2/20 0.30

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
SCHEMBL24249763 0.98 RAB9A (0.33) RAB9ALMNAHTTSMN1; SMN2BRD4
SCHEMBL22593916 0.97 RAB9A (0.34) RAB9ALMNAHTTSMN1; SMN2BRD4
SCHEMBL20866495 0.83 RAB9A (0.36) RAB9ALMNAHTTSMN1; SMN2POLB
SCHEMBL17051109 0.82 POLB (0.36) RAB9ALMNAHTTSMN1; SMN2BRD4
SCHEMBL23328663 0.79 POLB (0.34) LMNABRD4POLBCYP1A2GAA
SCHEMBL20866435 0.78 SSTR4 (0.33) RAB9ALMNAHTTSMN1; SMN2BRD4
SCHEMBL23921818 0.78 HTR2A (0.36)
SCHEMBL15730560 0.77 SSTR4 (0.35) BRD4POLBCYP1A2GAAGRM5
SCHEMBL23921642 0.74 PIK3CD (0.30)
SCHEMBL14751327 0.71 BRD4 (0.44) RAB9ALMNAHTTSMN1; SMN2BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212204-A1 REAGENTS AND THEIR USE FOR MODULAR ENANTIODIVERGENT SYNTHESIS OF C-P BONDS THE SCRIPPS RESEARCH INSTITUTE 2023-07-06 US disclosed
US-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2023-07-04 US disclosed
US-10253044-B2 9H-pyrimido [4,5-b]indoles and related analogs as BET bromodomain inhibitors THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-04-09 US disclosed
US-20170210761-A1 9H-PYRIMIDO [4,5-B]INDOLES AND RELATED ANALOGS AS BET BROMODOMAIN INHIBITORS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2017-07-27 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 (4 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-20170210761-A1 9H-PYRIMIDO [4,5-B]INDOLES AND RELATED ANALOGS AS BET BROMODOMAIN INHIBITORS BRD4, BRD3, BRD1 RAB9A 895/4885LMNA 1926/4885HTT 2341/4885
US-10253044-B2 9H-pyrimido [4,5-b]indoles and related analogs as BET bromodomain inhibitors BRD4, BRD3, BRD1 RAB9A 895/4885LMNA 1926/4885HTT 2341/4885
US-20230212204-A1 REAGENTS AND THEIR USE FOR MODULAR ENANTIODIVERGENT SYNTHESIS OF C-P BONDS PNKP, POLL, RNGTT RAB9A 2448/4885LMNA 3270/4885HTT 3532/4885
US-11691989-B2 Macrocyclic indoles as Mcl-1 inhibitors MCL1, BCL2A1, BCL2L1 RAB9A 1148/4885LMNA 1646/4885HTT 737/4885

“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.