SCHEMBL615475

SCHEMBL615475

CCn1c(C)nc2ccc(N)cc21

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.73
RAD52 P43351 1/20 0.73
ACSS2 Q9NR19 1/20 0.55
KMT2A Q03164 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
ALDH1A1 P00352 5/20 0.49
HPGD P15428 3/20 0.49
MAPT P10636 3/20 0.47
GAA P10253 2/20 0.47
GFER P55789 1/20 0.47
HTT P42858 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
CYP1A2 P05177 2/20 0.45
HSD17B10 Q99714 2/20 0.45
CYP2D6 P10635 1/20 0.45
RPS6KA5 O75582 2/20 0.44
LMNA P02545 2/20 0.43
TLR8 Q9NR97 1/20 0.43
TSHR P16473 2/20 0.43
MEN1 O00255 1/20 0.42

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
SCHEMBL616998 0.86 KDM4E (0.97) KDM4ERAD52KMT2ATDP1ALDH1A1
Hydrochloric Acid SCHEMBL6605580 0.85 KDM4E (1.00) KDM4ERAD52KMT2ATDP1ALDH1A1
Hydrochloric Acid SCHEMBL16736724 0.85 KDM4E (1.00) KDM4ERAD52KMT2ATDP1ALDH1A1
SCHEMBL939056 0.84 TLR8 (0.56) KDM4ERAD52ACSS2KMT2AALDH1A1
SCHEMBL21803210 0.82 ACSS2 (0.55) KDM4ERAD52ACSS2KMT2ATDP1
SCHEMBL617957 0.82 KDM4E (0.51) KDM4ERAD52ACSS2ALDH1A1HPGD
SCHEMBL623380 0.81 KDM4E (0.51) KDM4ERAD52ACSS2KMT2ATDP1
SCHEMBL615476 0.80 TNF (0.68) KDM4ERAD52ACSS2ALDH1A1HPGD
SCHEMBL3622413 0.80 KDM4E (0.49) KDM4ERAD52ACSS2KMT2ATDP1
SCHEMBL21803208 0.79 KDM4E (0.51) KDM4ERAD52ACSS2KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120041207-A1 Compound STERIX LIMITED (GB) 2012-02-16 US disclosed
US-20110009448-A1 Compound STERIX LIMITED 2011-01-13 US disclosed
US-7786152-B2 Compound STERIX LIMITED (GB) 2010-08-31 US disclosed
US-20080114042-A1 Inhibiting 11 beta-hydroxysteroid dehydrogenase (11 beta-HSD); use of sulfonamide-substituted N-heterocyclics including pyrroles, oxazoles, thiazoles, imidazoles and their fused analogs to treat diabetes, obesity, hypertension, arthritis, asthma, osteoporosis, breast cancer STERIX LIMITED (GB) 2008-05-15 US disclosed
US-7309715-B2 Compound STERIX LIMITED (GB) 2007-12-18 US disclosed
EP-1556040-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AND TYPE 2 Sterix Limited (GB) 2005-07-27 EP disclosed
US-20040143124-A1 Compound STERIX LIMITED (GB) 2004-07-22 US disclosed
WO-2004037251-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AND TYPE 2 STERIX LIMITED (GB) 2004-05-06 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 (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-20080114042-A1 Inhibiting 11 beta-hydroxysteroid dehydrogenase (11 beta-HSD); use of sulfonamide-substituted N-heterocyclics including pyrroles, oxazoles, thiazoles, imidazoles and their fused analogs to treat diabetes, obesity, hypertension, arthritis, asthma, osteoporosis, breast cancer HSD11B1, HSD3B1, HSD11B2 KDM4E 2033/4885RAD52 2526/4885ACSS2 405/4885
US-20110009448-A1 Compound NR4A1, GPR6, PRMT6 KDM4E 565/4885RAD52 947/4885ACSS2 3183/4885
US-20120041207-A1 Compound NR4A1, GPR6, PRMT6 KDM4E 565/4885RAD52 947/4885ACSS2 3183/4885
US-20040143124-A1 Compound NR4A1, CBR1, NR2C2 KDM4E 893/4885RAD52 762/4885ACSS2 3069/4885

“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.