SCHEMBL3017918

SCHEMBL3017918

COc1ccc(OC)c(Cc2csc(N3CCC(S(=O)(=O)c4c(C(C)C)cc(C(C)C)cc4C(C)C)CC3)n2)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
F2RL3 Q96RI0 11/20 0.35
MAPT P10636 3/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
ADRB2 P07550 1/20 0.35
TSHR P16473 1/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
REV1 Q9UBZ9 1/20 0.33

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
SCHEMBL3007049 0.94 F2RL3 (0.36) RAB9ASMN1; SMN2F2RL3MAPTLMNA
SCHEMBL3011245 0.90 HRH3 (0.35) F2RL3MAPTLMNAHSD17B10
SCHEMBL3000434 0.89 RAB9A (0.38) RAB9ASMN1; SMN2F2RL3MAPTPOLB
SCHEMBL3013521 0.88 RAB9A (0.36) RAB9ASMN1; SMN2F2RL3MAPTPOLB
SCHEMBL3007526 0.87 MAPT (0.39) SMN1; SMN2F2RL3MAPTLMNATSHR
SCHEMBL3022621 0.87 MAPT (0.40) F2RL3MAPTLMNAPOLBRECQL
SCHEMBL3008408 0.87 F2RL3 (0.36) RAB9ASMN1; SMN2F2RL3ALDH1A1
SCHEMBL3005645 0.86 MAPT (0.40) RAB9ASMN1; SMN2F2RL3MAPTLMNA
SCHEMBL3008540 0.85 RAB9A (0.38) RAB9ASMN1; SMN2F2RL3MAPTLMNA
SCHEMBL3007270 0.85 L3MBTL1 (0.38) RAB9ASMN1; SMN2F2RL3MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722681-B2 N-sulfonyl thiazolylpiperazine derivatives and related N-sulfonyl heterocyclic derivatives for the treatment of neuro degenerative diseases NV REMYND (BE) 2014-05-13 US disclosed
US-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES NV REMYND (BE) 2010-08-05 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 (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-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES SMN1; SMN2, HTT, SNCA RAB9A 2943/4885SMN1; SMN2 1/4885F2RL3 3732/4885

“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.