SCHEMBL6139623

SCHEMBL6139623

CSC(=CC(=O)c1ccc(C)cc1)SC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.69
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
ALDH1A1 P00352 8/20 0.59
HTT P42858 4/20 0.59
NPSR1 Q6W5P4 4/20 0.59
LMNA P02545 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
PKM P14618 2/20 0.59
ATM Q13315 2/20 0.59
HPGD P15428 2/20 0.59
NLRP1 Q9C000 1/20 0.59
NTSR1 P30989 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
THRB P10828 1/20 0.52
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
CYP1B1 Q16678 1/20 0.46

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
SCHEMBL8402763 0.84 ALDH1A1 (0.55) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL28474124 0.83 MEN1 (0.74) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6139630 0.82 MAPT (1.00) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL9210472 0.82 MAPT (0.67) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL6218138 0.82 MAPT (0.67) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL16052890 0.81 MEN1 (0.65) MAPTMEN1KMT2AALDH1A1NPSR1
SCHEMBL5931364 0.81 MEN1 (1.00) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL11048818 0.79 MAPT (0.62) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL1162890 0.79 MAPT (0.62) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL8844390 0.78 ALDH1A1 (0.64) MAPTMEN1KMT2AALDH1A1HTT

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-11767297-B2 Compounds for inhibiting TNIK and medical uses thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-09-26 US disclosed
US-6844337-B2 1,4-diazabicyclo[3.2.2]nonane-phenylisoxazole derivatives, their preparation and their application in therapeutics SANOFI-SYNTHELABO (FR) 2005-01-18 US disclosed
EP-1289986-B1 1,4-DIAZABICYCLO 3.2.2]NONANE-PHENYLISOXAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SYNTHELABO (FR) 2004-04-28 EP disclosed
US-20030114461-A1 1,4-Diazabicyclo[3.2.2]nonane-phenylisoxazole derivatives, preparation and therapeutic use thereof SANOFI (FR) 2003-06-19 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 (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-20030114461-A1 1,4-Diazabicyclo[3.2.2]nonane-phenylisoxazole derivatives, preparation and therapeutic use thereof CYC1, GLRA1, CBR1 MAPT 4765/4885MEN1 1537/4885KMT2A 3489/4885
US-11767297-B2 Compounds for inhibiting TNIK and medical uses thereof TNNI3K, TNK1, TNIK MAPT 3588/4885MEN1 2818/4885KMT2A 2586/4885

“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.