SCHEMBL1962664

SCHEMBL1962664

C1=Cc2ccccc2N2CC=CC2=C1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 2/20 0.33
P2RX3 P56373 2/20 0.33
P2RX4 Q99571 2/20 0.33
LMNA P02545 2/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
SCN4A P35499 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL351980 0.86 LMNA (0.35) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL21815682 0.72 SIGMAR1 (0.38) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL30292820 0.72 SIGMAR1 (0.38) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL28423984 0.70 SIGMAR1 (0.36) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL21066586 0.70 KEAP1 (0.41) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL1408252 0.70 SIGMAR1 (0.36) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL22028459 0.70 SIGMAR1 (0.36) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL30919258 0.70 SIGMAR1 (0.36) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL30679849 0.70 SIGMAR1 (0.36) P2RX1P2RX3P2RX4LMNATSHR
SCHEMBL29363156 0.70 SIGMAR1 (0.36) P2RX1P2RX3P2RX4LMNATSHR

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-9701686-B2 Tricyclopyrazole derivatives NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-07-11 US disclosed
US-20150329552-A1 TRICYCLOPYRAZOLE DERIVATIVES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-11-19 US disclosed
US-9127015-B2 Tricyclopyrazole derivatives NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-09-08 US disclosed
EP-2507244-B1 TRICYCLOPYRAZOLE DERIVATIVES NERVIANO MEDICAL SCIENCES SRL (IT) 2014-11-05 EP disclosed
US-20120277214-A1 TRICYCLOPYRAZOLE DERIVATIVES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-11-01 US disclosed
EP-2507244-A1 TRICYCLOPYRAZOLE DERIVATIVES Nerviano Medical Sciences S.r.l. (IT) 2012-10-10 EP disclosed
WO-2011067145-A1 TRICYCLOPYRAZOLE DERIVATIVES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-06-09 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-20150329552-A1 TRICYCLOPYRAZOLE DERIVATIVES CDK3, MAP3K15, CDK6 P2RX1 2705/4885P2RX3 2258/4885P2RX4 2317/4885
US-20120277214-A1 TRICYCLOPYRAZOLE DERIVATIVES CDK3, MAP3K15, CDK6 P2RX1 2705/4885P2RX3 2258/4885P2RX4 2317/4885

“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.