SCHEMBL19575465

SCHEMBL19575465

COc1cc(C)nc(Nc2cc(N)ccc2C)n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.46
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 2/20 0.43
ABL1 P00519 1/20 0.43
BCR P11274 1/20 0.43
MAPT P10636 4/20 0.42
LMNA P02545 3/20 0.42
HIF1A Q16665 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
LCK P06239 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
PKM P14618 1/20 0.39
GFER P55789 1/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL3217659 0.82 ABL1 (0.56) ABL1BCRLCKNPC1RAB9A
SCHEMBL19575463 0.78 ALDH1A1 (0.76) HTTALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL19346001 0.74 HTT (0.46) HTTALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL4735744 0.74 ABL1 (0.54) HTTALDH1A1SMN1; SMN2ABL1BCR
SCHEMBL19575462 0.73 ALDH1A1 (0.49) HTTALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL21004545 0.73 HTT (0.45) HTTALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL21004544 0.72 HTT (0.44) HTTALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL4735737 0.72 ABL1 (0.52) HTTALDH1A1SMN1; SMN2ABL1BCR
SCHEMBL9847096 0.71 HTT (0.54) HTTALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL9795720 0.71 HTT (0.63) HTTALDH1A1SMN1; SMN2TSHRMAPT

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
EP-3452465-B1 SUBSTITUTED 2, 4-DIAMINO-QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES GENOSCIENCE PHARMA (FR) 2020-11-04 EP disclosed
US-10577362-B2 Substituted 2, 4-diamino-quinoline derivatives for use in the treatment of proliferative diseases GENOSCIENCE PHARMA (FR) 2020-03-03 US disclosed
US-20190144437-A1 SUBSTITUTED 2, 4-DIAMINO-QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES GENOSCIENCE PHARMA (FR) 2019-05-16 US disclosed
WO-2017191599-A1 SUBSTITUTED 2, 4-DIAMINO-QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES GENOSCIENCE PHARMA (FR) 2017-11-09 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 (2 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-20190144437-A1 SUBSTITUTED 2, 4-DIAMINO-QUINOLINE DERIVATIVES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES NQO2, RECQL, CCNO HTT 2539/4885ALDH1A1 334/4885SMN1; SMN2 2132/4885
US-10577362-B2 Substituted 2, 4-diamino-quinoline derivatives for use in the treatment of proliferative diseases NQO2, RECQL, CCNO HTT 2539/4885ALDH1A1 334/4885SMN1; SMN2 2132/4885

“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.