SCHEMBL147237

SCHEMBL147237

COc1cc2cc(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)nc(C)c2cc1OC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAC1 P63000 4/20 0.68
KDM4E B2RXH2 6/20 0.65
MEN1 O00255 5/20 0.65
KMT2A Q03164 5/20 0.65
NPC1 O15118 1/20 0.65
RAB9A P51151 1/20 0.65
MAPT P10636 2/20 0.63
ALDH1A1 P00352 4/20 0.58
GAA P10253 2/20 0.58
POLB P06746 1/20 0.53
HPGD P15428 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 1/20 0.51
USP2 O75604 2/20 0.50
HSD17B10 Q99714 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ACACA Q13085 1/20 0.48
TSHR P16473 2/20 0.48
ATM Q13315 2/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL147920 0.93 RAC1 (0.71) RAC1KDM4EMEN1KMT2ANPC1
SCHEMBL3320127 0.92 KDM4E (0.75) RAC1KDM4EMEN1KMT2ANPC1
SCHEMBL215619 0.92 RAC1 (0.73) RAC1KDM4EMEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL3318499 0.91 RAC1 (0.74) RAC1KDM4EMEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL3318494 0.91 RAC1 (0.74) RAC1KDM4EMEN1KMT2ANPC1
SCHEMBL16510485 0.85 KDM4E (0.63) RAC1KDM4EMEN1KMT2ANPC1
SCHEMBL12070505 0.84 RAD52 (0.53) RAC1KDM4EMEN1KMT2ANPC1
SCHEMBL9986895 0.84 SMN1; SMN2 (0.50) RAC1KDM4EMEN1KMT2ANPC1
SCHEMBL14930629 0.84 RAC1 (0.60) RAC1KDM4EMEN1KMT2ANPC1
SCHEMBL13076486 0.82 RAC1 (0.68) RAC1KDM4EMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9227966-B2 Antimicrobial agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-01-05 US disclosed
US-9227966-B2 Antimicrobial agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-01-05 US disclosed
US-20140315939-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2014-10-23 US disclosed
US-20140315939-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2014-10-23 US disclosed
US-20120059026-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-03-08 US disclosed
US-20120059026-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-03-08 US disclosed
WO-2010127307-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2010-11-04 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-20120059026-A1 ANTIMICROBIAL AGENTS ZYX, Q6ZSR9, ZC3HAV1L RAC1 331/4885KDM4E 2001/4885MEN1 623/4885
US-20140315939-A1 ANTIMICROBIAL AGENTS ZYX, Q6ZSR9, ZC3HAV1L RAC1 254/4885KDM4E 1992/4885MEN1 580/4885

“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.