SCHEMBL18160280

SCHEMBL18160280

Cc1ccc(Cl)c(C(=O)Nc2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.67
JAK1 P23458 1/20 0.67
TYK2 P29597 1/20 0.67
P2RX1 P51575 2/20 0.58
TMPRSS4 Q9NRS4 2/20 0.58
P2RX4 Q99571 1/20 0.58
P2RX7 Q99572 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.53
LMNA P02545 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
GMNN O75496 1/20 0.53
TP53 P04637 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
HTR1A P08908 1/20 0.53
THRB P10828 1/20 0.53
PIM1 P11309 1/20 0.53
CYP2C9 P11712 1/20 0.53
MAOA P21397 1/20 0.53

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
SCHEMBL24460414 0.84 P2RX1 (0.80) P2RX1TMPRSS4P2RX4P2RX7SMN1; SMN2
SCHEMBL18160382 0.84 F10 (0.62) P2RX1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL18160306 0.84 HDAC8 (0.68) JAK2JAK1TYK2P2RX1SMN1; SMN2
SCHEMBL18146038 0.83 JAK2 (0.67) JAK2JAK1TYK2P2RX1TMPRSS4
SCHEMBL25348875 0.82 P2RX1 (0.63) P2RX1TMPRSS4P2RX4P2RX7SMN1; SMN2
SCHEMBL18160302 0.81 TYK2 (0.73) JAK2JAK1TYK2SMN1; SMN2CYP3A4
SCHEMBL18160386 0.81 MEN1 (0.69) SMN1; SMN2LMNARAB9ATP53CYP1A2
SCHEMBL5369677 0.80 RORC (0.76) JAK2JAK1TYK2P2RX1TMPRSS4
SCHEMBL18146911 0.79 SMN1; SMN2 (0.71) JAK2JAK1TYK2P2RX1TMPRSS4
SCHEMBL18160389 0.79 NPC1 (0.54) SMN1; SMN2LMNANPC1RAB9ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170339961-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-11-30 US disclosed
US-9781935-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-10-10 US disclosed
US-20160304522-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2016-10-20 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 (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-20160304522-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD JAK2 2264/4885JAK1 1875/4885TYK2 3530/4885
US-20170339961-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD JAK2 2264/4885JAK1 1875/4885TYK2 3530/4885

“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.