SCHEMBL4903017

SCHEMBL4903017

O=C1CCCCN1c1ccc(Nc2cccc(-c3ncc(Cl)s3)n2)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.40
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
F2 P00734 1/20 0.35
AKR1C3 P42330 1/20 0.34
HPGDS O60760 1/20 0.34
CCNT1 O60563 1/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
CDK9 P50750 1/20 0.34
CDK6 Q00534 1/20 0.34
CDK11A Q9UQ88 1/20 0.34
MAPK8 P45983 1/20 0.34
MAPK9 P45984 1/20 0.34
MAPK10 P53779 1/20 0.34
CNR2 P34972 1/20 0.34
HTR6 P50406 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL4900748 0.97 F10 (0.37) F10LMNAHPGDTSHRAKR1C3
Hydrochloric Acid SCHEMBL5312344 0.96 F10 (0.36) F10LMNAHPGDTSHRAKR1C3
SCHEMBL4895704 0.88 F10 (0.36) F10AKR1C3HPGDSHTR6FFAR1
SCHEMBL5262033 0.86 F10 (0.35) F10LMNAHPGDTSHRAKR1C3
SCHEMBL4899219 0.86 F10 (0.35) F10AKR1C3HPGDSCDK4CCND1
Hydrochloric Acid SCHEMBL4896752 0.85 F10 (0.35) F10LMNAHPGDTSHRAKR1C3
SCHEMBL4892130 0.84 CCNA2 (0.44) CCNT1CDK4CCND1CDK9CDK6
SCHEMBL4901325 0.84 PIP4K2A (0.38) F10HPGDAKR1C3HPGDSCCNT1
Hydrochloric Acid SCHEMBL4896665 0.84 NPC1 (0.36) LMNAHPGDAKR1C3HPGDSMAPK8
Hydrochloric Acid SCHEMBL5315908 0.84 CDK6 (0.40) CCNT1CDK4CCND1CDK9CDK6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators ICAGEN, INC. (US) 2008-05-08 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-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators KCNJ2, KCNH2, KCNQ1 F10 1686/4885LMNA 3338/4885HPGD 1598/4885

“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.