SCHEMBL2960952

SCHEMBL2960952

Cc1ccc(Oc2ccccc2)c(Nc2ccnc3nc(C)ccc23)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 3/20 0.46
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
POLB P06746 1/20 0.39
TP53 P04637 2/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
KDR P35968 2/20 0.38
ERBB2 P04626 1/20 0.38
ATM Q13315 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADORA2A P29274 1/20 0.37
GCK P35557 1/20 0.36
HPGD P15428 1/20 0.35
MAPT P10636 1/20 0.35
PIK3C3 Q8NEB9 1/20 0.35

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
SCHEMBL2969814 0.89 ADORA1 (0.45) ADORA1MEN1KMT2ATP53LMNA
SCHEMBL2964444 0.89 RIPK2 (0.39) ADORA1MEN1KMT2ATP53LMNA
SCHEMBL2968656 0.86 MEN1 (0.36) MEN1KMT2APOLBTP53LMNA
SCHEMBL2961811 0.82 PIM1 (0.46) ADORA1MEN1KMT2APOLBTP53
SCHEMBL2955700 0.78 IGF1R (0.45) KMT2APOLBGAAKDRATM
SCHEMBL2968548 0.78 IGF1R (0.42) KMT2APOLBGAATSHRHPGD
SCHEMBL2018796 0.77 PIM1 (0.42) ADORA1MEN1KMT2APOLBLMNA
SCHEMBL2968384 0.77 MRGPRX4 (0.49) POLBLMNA
SCHEMBL2971758 0.77 MAPKAPK2 (0.46) ADORA1MEN1KMT2ATP53GAA
SCHEMBL2966309 0.76 RAF1 (0.41) MEN1KMT2ATP53TSHRSMN1; SMN2

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-8338605-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2012-12-25 US disclosed
US-20100256139-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2010-10-07 US disclosed
EP-1979349-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2010-07-28 EP disclosed
US-7763731-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2010-07-27 US disclosed
EP-1979349-A2 ANTI-VIRAL COMPOUNDS Abbott Laboratories (US) 2008-10-15 EP disclosed
US-20070232645-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 US disclosed
WO-2007076035-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2007-07-05 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-20070232645-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 ADORA1 3948/4885MEN1 4571/4885KMT2A 3566/4885
US-20100256139-A1 Anti-Viral Compounds HAVCR2, MAVS, EIF2AK2 ADORA1 3948/4885MEN1 4571/4885KMT2A 3566/4885

“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.