SCHEMBL2210808

SCHEMBL2210808

O=C1Cc2ccccc2CN1C1CCNCC1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.49
HTR2C P28335 9/20 0.46
HTR2B P41595 6/20 0.46
HTR2A P28223 5/20 0.45
NAMPT P43490 2/20 0.39
ACHE P22303 1/20 0.36

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
SCHEMBL30658421 1.00 PARP1 (0.49) PARP1HTR2CHTR2BHTR2ANAMPT
Hydrochloric Acid SCHEMBL3888469 0.98 PARP1 (0.48) PARP1HTR2CHTR2BHTR2ANAMPT
SCHEMBL23004922 0.83 OPRM1 (0.49) PARP1
SCHEMBL30278373 0.83 OPRM1 (0.49) PARP1
SCHEMBL9280480 0.81 HTR2C (0.56) PARP1HTR2CHTR2BHTR2ANAMPT
SCHEMBL1976916 0.77 PARP1 (0.56) PARP1HTR2CHTR2BHTR2A
SCHEMBL7985474 0.77 HTR2C (0.50) PARP1HTR2CHTR2BHTR2ANAMPT
SCHEMBL2100919 0.76 BRD4 (0.50) PARP1HTR2CHTR2BHTR2A
SCHEMBL31184549 0.76 BRD4 (0.50) PARP1HTR2CHTR2BHTR2A
SCHEMBL31184539 0.76 BRD4 (0.50) PARP1HTR2CHTR2BHTR2A

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174631-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING FGF ACTIVITY RECOVERY THERAPEUTICS, INC. 2024-05-30 US disclosed
EP-4291177-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING FGF ACTIVITY Recovery Therapeutics, Inc. (US) 2023-12-20 EP disclosed
CN-117157069-A Compounds, compositions and methods for modulating FGF activity 康复治疗公司 2023-12-01 CN disclosed
WO-2022174083-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING FGF ACTIVITY RECOVERY THERAPEUTICS, INC. (US) 2022-08-18 WO disclosed
US-20180015085-A1 CGRP Receptor Antagonists NXERA PHARMA UK LIMITED (GB) 2018-01-18 US disclosed
US-20180009808-A1 CGRP Receptor Antagonists NXERA PHARMA UK LIMITED (GB) 2018-01-11 US disclosed
US-9808457-B2 CGRP receptor antagonists HEPTARES THERAPEUTICS LIMITED (GB) 2017-11-07 US disclosed
US-9802935-B2 CGRP receptor antagonists HEPTARES THERAPEUTICS LIMITED (GB) 2017-10-31 US disclosed
US-20170121348-A1 CGRP Receptor Antagonists NXERA PHARMA UK LIMITED (GB) 2017-05-04 US disclosed
US-20170121331-A1 CGRP Receptor Antagonists NXERA PHARMA UK LIMITED (GB) 2017-05-04 US disclosed
WO-2007130860-A2 CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-15 WO disclosed
WO-2007130860-A2 CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-15 WO disclosed
WO-2007130927-A2 CONDENSED TRICYCLIC COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-15 WO disclosed
US-20070259850-A1 CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY 2007-11-08 US disclosed
US-20070259850-A1 CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY 2007-11-08 US disclosed
US-20070259850-A1 CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY 2007-11-08 US disclosed
EP-1809633-A1 CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS Brystol-Myers Squibb Company (US) 2007-07-25 EP disclosed
US-20060229447-A1 Constrained compounds as CGRP-receptor antagonists BRISTOL-MYERS SQUIBB COMPANY 2006-10-12 US disclosed
WO-2006052378-A1 CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-05-18 WO disclosed
US-20060094707-A1 Constrained compounds as CGRP-receptor antagonists BRISTOL-MYERS SQUIBB COMPANY 2006-05-04 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 (8 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-20180009808-A1 CGRP Receptor Antagonists CALCRL, CALCR, VIPR1 PARP1 1803/4885HTR2C 465/4885HTR2B 294/4885
US-20060229447-A1 Constrained compounds as CGRP-receptor antagonists CALCR, BDKRB2, CALCRL PARP1 876/4885HTR2C 198/4885HTR2B 181/4885
US-20070259850-A1 CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS CALCR, BDKRB2, CALCRL PARP1 876/4885HTR2C 198/4885HTR2B 181/4885
US-20060094707-A1 Constrained compounds as CGRP-receptor antagonists CALCR, BDKRB2, CALCRL PARP1 876/4885HTR2C 198/4885HTR2B 181/4885
US-20240174631-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING FGF ACTIVITY FGF1, FGF2, FGFR1 PARP1 4719/4885HTR2C 1517/4885HTR2B 2151/4885
US-20180015085-A1 CGRP Receptor Antagonists CALCRL, CALCR, VIPR1 PARP1 1981/4885HTR2C 464/4885HTR2B 271/4885
US-20170121331-A1 CGRP Receptor Antagonists CALCRL, CALCR, VIPR1 PARP1 1803/4885HTR2C 465/4885HTR2B 294/4885
US-20170121348-A1 CGRP Receptor Antagonists CALCRL, CALCR, VIPR1 PARP1 1981/4885HTR2C 464/4885HTR2B 271/4885

“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.