SCHEMBL5651532

SCHEMBL5651532

O=C(NN1CCCCC1)c1ccc(-c2nc3cc(Cl)c(F)cc3[nH]2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.43
PRSS12 P56730 3/20 0.42
HDAC6 Q9UBN7 3/20 0.41
CNR1 P21554 8/20 0.40
CNR2 P34972 4/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RHEB Q15382 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39

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
SCHEMBL5650995 0.95 PRSS12 (0.47) KDRPRSS12HDAC6CNR1CNR2
SCHEMBL5650474 0.92 CNR1 (0.41) KDRPRSS12CNR1CNR2RHEB
SCHEMBL5652794 0.92 PRSS12 (0.41) KDRPRSS12HDAC6CNR1CNR2
SCHEMBL5653971 0.92 AMY1A (0.42) KDRPRSS12HDAC6CNR1CNR2
SCHEMBL5651818 0.89 FOXO1 (0.42) KDRPRSS12HDAC6CNR1CNR2
SCHEMBL5653630 0.88 PRSS12 (0.54) KDRPRSS12HDAC6RHEB
SCHEMBL5652478 0.87 HDAC6 (0.48) HDAC6CNR1MEN1CYP1A2MAPT
SCHEMBL5652578 0.87 SIRT2 (0.42) PRSS12CNR1CNR2MEN1MAPT
SCHEMBL5652259 0.83 PRSS12 (0.47) KDRPRSS12HDAC6CNR1CNR2
SCHEMBL5650683 0.83 RHEB (0.47) PRSS12CNR1CNR2RHEB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220769-B2 Azolylbenzamides and analogues and their use for treating osteoporosis NIKEM RESEARCH S.R.L. (IT) 2007-05-22 US disclosed
US-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis 3-V BIOSCIENCES, INC. 2005-02-17 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-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis NR0B2, NR0B1, NCOR1 KDR 2994/4885PRSS12 979/4885HDAC6 537/4885

“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.