SCHEMBL9922290

SCHEMBL9922290

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(N3C(=O)Cc4cc(NCCN5CCOCC5)ccc4C3=O)nc2)s1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
KCNH2 Q12809 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
ABHD6 Q9BV23 1/20 0.35
MAPK14 Q16539 4/20 0.35
EPHX2 P34913 3/20 0.34
HTT P42858 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
LCK P06239 1/20 0.34
BRD4 O60885 1/20 0.33
CREBBP Q92793 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
SCHEMBL14228332 0.94 HRH3 (0.35) KCNH2BRD4CREBBP
SCHEMBL9922278 0.93 HRH3 (0.36) KCNH2BRD4CREBBP
SCHEMBL12160943 0.93 PSEN1 (0.41) LMNACYP3A4CYP2D6CYP2C9KCNH2
SCHEMBL9922195 0.93 LMNA (0.38) LMNACYP3A4CYP2D6CYP2C9KCNH2
SCHEMBL9922423 0.90 HTT (0.41) LMNAADORA2AADORA1ABHD6MAPK14
SCHEMBL12177069 0.89 BRD4 (0.35) BRD4CREBBPNAMPT
SCHEMBL9922368 0.89 CRHBP (0.38) LMNAEPHX2NAMPTSMN1; SMN2
SCHEMBL9922477 0.89 KMT2A (0.46) EPHX2PSEN1PSEN2APH1BNCSTN
SCHEMBL12177196 0.87 BRD4 (0.37) LMNAADORA2AADORA1ABHD6MAPK14
SCHEMBL9922196 0.86 KCNH2 (0.34) KCNH2PSEN1PSEN2APH1BNCSTN

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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 LMNA 3603/4885CYP3A4 1776/4885CYP2D6 1142/4885

“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.