SCHEMBL6135516

SCHEMBL6135516

C[C@H]1CC[C@@H](N2CCN(c3ccc(-c4ccc(C(=O)O)cc4)cc3)CC2)CC1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.67
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
CHEK1 O14757 2/20 0.51
ITGB3 P05106 1/20 0.50
ITGA2B P08514 1/20 0.50
ALOX15 P16050 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.46
MBTD1 Q05BQ5 1/20 0.46
TP53BP1 Q12888 1/20 0.46
L3MBTL4 Q8NA19 1/20 0.46
L3MBTL3 Q96JM7 1/20 0.46
KDM4E B2RXH2 5/20 0.46
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 2/20 0.44
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43

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
SCHEMBL6134910 1.00 USP2 (0.67) USP2MEN1KMT2ACHEK1ITGB3
SCHEMBL6134907 1.00 USP2 (0.67) USP2MEN1KMT2ACHEK1ITGB3
SCHEMBL1305974 0.89 USP2 (0.63) USP2MEN1KMT2AITGB3ITGA2B
SCHEMBL6135370 0.88 USP2 (0.55) USP2MEN1KMT2ACHEK1ITGB3
SCHEMBL6135376 0.88 USP2 (0.55) USP2MEN1KMT2ACHEK1ITGB3
Hydrochloric Acid SCHEMBL6135021 0.87 USP2 (0.54) USP2MEN1KMT2ACHEK1ITGB3
SCHEMBL6132350 0.87 MEN1 (0.74) USP2MEN1KMT2ACHEK1ITGB3
SCHEMBL6132349 0.87 MEN1 (0.74) USP2MEN1KMT2ACHEK1ITGB3
SCHEMBL6369559 0.86 USP2 (0.54) USP2MEN1KMT2ACHEK1ITGB3
SCHEMBL6134695 0.86 KMT2A (0.53) USP2MEN1KMT2AITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 US disclosed
EP-1366066-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-03 EP disclosed
WO-2002072621-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-19 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 USP2 4776/4885MEN1 880/4885KMT2A 4492/4885

“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.