SCHEMBL6162279

SCHEMBL6162279

Cc1ccc(S(=O)(=O)NC2CCNC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.62
TSHR P16473 2/20 0.62
CYP3A4 P08684 1/20 0.62
HDAC4 P56524 1/20 0.52
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
NAMPT P43490 1/20 0.50
KDM4E B2RXH2 1/20 0.50
RECQL P46063 1/20 0.50
REN P00797 3/20 0.49
PSEN1 P49768 2/20 0.47
PSEN2 P49810 2/20 0.47
APH1B Q8WW43 2/20 0.47
NCSTN Q92542 2/20 0.47
APH1A Q96BI3 2/20 0.47
PSENEN Q9NZ42 2/20 0.47
KDR P35968 1/20 0.46
IKBKB O14920 1/20 0.45
JAK2 O60674 1/20 0.45
ROCK2 O75116 1/20 0.45

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
SCHEMBL17277317 1.00 ALDH1A1 (0.62) ALDH1A1TSHRCYP3A4HDAC4HTT
SCHEMBL17277502 1.00 ALDH1A1 (0.62) ALDH1A1TSHRCYP3A4HDAC4HTT
SCHEMBL17277312 0.91 ALDH1A1 (0.68) ALDH1A1TSHRCYP3A4HTTSMN1; SMN2
SCHEMBL17277267 0.91 ALDH1A1 (0.68) ALDH1A1TSHRCYP3A4HTTSMN1; SMN2
SCHEMBL995294 0.91 ALDH1A1 (0.68) ALDH1A1TSHRCYP3A4HTTSMN1; SMN2
SCHEMBL14538236 0.90 ALDH1A1 (0.71) ALDH1A1TSHRCYP3A4HTTSMN1; SMN2
SCHEMBL4668508 0.90 ALDH1A1 (0.70) ALDH1A1TSHRCYP3A4HTTSMN1; SMN2
SCHEMBL17247776 0.87 ALDH1A1 (0.65) ALDH1A1TSHRCYP3A4HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL17255472 0.85 ALDH1A1 (0.63) ALDH1A1TSHRCYP3A4HTTSMN1; SMN2
SCHEMBL1685108 0.84 HDAC4 (0.52) ALDH1A1TSHRCYP3A4HDAC4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed
US-5936089-A PIPERIDINE DERIVATIVES; BONE DISORDERS; OBESITY; AGING; CACHEXIA ASSOCIATED WITH AIDS AND CANCER PFIZER INC (US) 1999-08-10 US disclosed
EP-0828754-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1998-03-18 EP disclosed
WO-1996038471-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER INC. (US) 1996-12-05 WO disclosed
WO-1996035713-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER, INC. (US) 1996-11-14 WO disclosed