SCHEMBL3066692

SCHEMBL3066692

O=C(c1nc2c(C(F)(F)F)cc(-c3cccc4cccnc34)cn2c1Cl)N1CCC(N2CCOC2=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.36
PIM1 P11309 2/20 0.34
PIM2 Q9P1W9 1/20 0.34
MAPT P10636 1/20 0.34
F10 P00742 1/20 0.33
VNN1 O95497 1/20 0.33
AVPR2 P30518 2/20 0.33
AVPR1A P37288 2/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
CALCRL Q16602 1/20 0.32
METAP2 P50579 1/20 0.32
WNT3 P56703 1/20 0.32
NPY5R Q15761 1/20 0.32
RORC P51449 1/20 0.32
P2RX7 Q99572 1/20 0.32
RBP4 P02753 1/20 0.32
SYK P43405 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL3066363 0.87 RBP4 (0.36) F10VNN1TRPV1NPY5RP2RX7
SCHEMBL3053754 0.85 SCD5 (0.39) F10VNN1TRPV1NPY5RRBP4
SCHEMBL3077029 0.85 S1PR1 (0.41) MAPTF10VNN1RBP4
SCHEMBL3068347 0.85 PIK3CA (0.37) F10VNN1CALCRLNPY5RP2RX7
SCHEMBL3071150 0.85 F10 (0.36) F10VNN1TRPV1NPY5RP2RX7
SCHEMBL3058415 0.84 PIK3CA (0.36) F10VNN1TRPV1NPY5RRORC
SCHEMBL3057911 0.84 NPY5R (0.40) F10VNN1CALCRLNPY5RRBP4
SCHEMBL3053749 0.83 F10 (0.36) F10VNN1TRPV1CALCRLNPY5R
SCHEMBL3071106 0.83 HSD11B1 (0.39) MAPTF10VNN1TRPV1NPY5R
SCHEMBL3068370 0.83 RBP4 (0.36) F10VNN1TRPV1NPY5RP2RX7

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
US-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents BASKARAN SUBRAMANIAN 2010-10-28 US claimed
US-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents BASKARAN SUBRAMANIAN 2010-10-28 US disclosed
US-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents BASKARAN SUBRAMANIAN 2010-10-28 US disclosed
US-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents BASKARAN SUBRAMANIAN 2010-10-28 US disclosed
WO-2010091411-A1 PIPERIDINYL CYCLIC AMIDO ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2010-08-12 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 (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-20100272680-A1 Piperidinyl Cyclic Amido Antiviral Agents ZC3HAV1, MAVS, EIF2AK2 CCR3 905/4885PIM1 2571/4885PIM2 2728/4885

“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.